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Azoles

Organic compounds that consist of five-membered heterocyclic molecules containing a nitrogen atom and at least one other non-carbon atom as part of the ring.
Imidazoles (676)
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Pyrazoles (278)
Triazoles (195)
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1 – 15 of 906 results
1

5-(Bromomethyl)-1-methyl-1H-1,2,3-benzotriazole, 90+%, Thermo Scientific™

CAS: 499770-76-2 Molecular Formula: C8H8BrN3 Molecular Weight (g/mol): 226.077 InChI Key: OSUZHHPMRAIJDY-UHFFFAOYSA-N Synonym: 5-bromomethyl-1-methyl-1h-benzo d 1,2,3 triazole,5-bromomethyl-1-methyl-1h-1,2,3-benzotriazole,5-bromomethyl-1-methylbenzotriazole,5-bromomethyl-1-methyl-benzotriazole,1h-benzotriazole, 5-bromomethyl-1-methyl,5-bromomethyl-1-methyl-1,2,3-benzotriazole,5-bromomethyl-1-methyl-1h-benzotriazole PubChem CID: 2795418 IUPAC Name: 5-(bromomethyl)-1-methylbenzotriazole SMILES: CN1C2=C(C=C(C=C2)CBr)N=N1

PubChem CID 2795418
CAS 499770-76-2
Molecular Weight (g/mol) 226.077
SMILES CN1C2=C(C=C(C=C2)CBr)N=N1
Synonym 5-bromomethyl-1-methyl-1h-benzo d 1,2,3 triazole,5-bromomethyl-1-methyl-1h-1,2,3-benzotriazole,5-bromomethyl-1-methylbenzotriazole,5-bromomethyl-1-methyl-benzotriazole,1h-benzotriazole, 5-bromomethyl-1-methyl,5-bromomethyl-1-methyl-1,2,3-benzotriazole,5-bromomethyl-1-methyl-1h-benzotriazole
IUPAC Name 5-(bromomethyl)-1-methylbenzotriazole
InChI Key OSUZHHPMRAIJDY-UHFFFAOYSA-N
Molecular Formula C8H8BrN3
2

2,5-Dimethyl-1,3-oxazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 23000-14-8 Molecular Formula: C6H7NO3 Molecular Weight (g/mol): 141.126 MDL Number: MFCD03011595 InChI Key: LHGRUGVXZLHYKE-UHFFFAOYSA-N Synonym: 2,5-dimethyloxazole-4-carboxylic acid,dimethyl-1,3-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 2,5-dimethyl,2,5-dimethyl-1,3-oxazole-4-carboxylicacid,4-carboxy-2,5-dimethyl-1,3-oxazole,2,5-dimethyl-oxazole-4-carboxylic acid,2.5-dimethyl-1,3-oxazole-4-carboxylic acid PubChem CID: 2795465 IUPAC Name: 2,5-dimethyl-1,3-oxazole-4-carboxylic acid SMILES: CC1=C(N=C(O1)C)C(=O)O

PubChem CID 2795465
CAS 23000-14-8
Molecular Weight (g/mol) 141.126
MDL Number MFCD03011595
SMILES CC1=C(N=C(O1)C)C(=O)O
Synonym 2,5-dimethyloxazole-4-carboxylic acid,dimethyl-1,3-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 2,5-dimethyl,2,5-dimethyl-1,3-oxazole-4-carboxylicacid,4-carboxy-2,5-dimethyl-1,3-oxazole,2,5-dimethyl-oxazole-4-carboxylic acid,2.5-dimethyl-1,3-oxazole-4-carboxylic acid
IUPAC Name 2,5-dimethyl-1,3-oxazole-4-carboxylic acid
InChI Key LHGRUGVXZLHYKE-UHFFFAOYSA-N
Molecular Formula C6H7NO3
3

4-(Bromomethyl)-5-methyl-3-phenylisoxazole, 97%, Thermo Scientific™

CAS: 180597-83-5 Molecular Formula: C11H10BrNO Molecular Weight (g/mol): 252.11 MDL Number: MFCD02677680 InChI Key: UICMWXWMCOJBIQ-UHFFFAOYSA-N PubChem CID: 2776147 IUPAC Name: 4-(bromomethyl)-5-methyl-3-phenyl-1,2-oxazole SMILES: CC1=C(CBr)C(=NO1)C1=CC=CC=C1

PubChem CID 2776147
CAS 180597-83-5
Molecular Weight (g/mol) 252.11
MDL Number MFCD02677680
SMILES CC1=C(CBr)C(=NO1)C1=CC=CC=C1
IUPAC Name 4-(bromomethyl)-5-methyl-3-phenyl-1,2-oxazole
InChI Key UICMWXWMCOJBIQ-UHFFFAOYSA-N
Molecular Formula C11H10BrNO
4

3-(Bromomethyl)-5-methylisoxazole, 97%, Thermo Scientific™

CAS: 130628-75-0 Molecular Formula: C5H6BrNO Molecular Weight (g/mol): 176.01 MDL Number: MFCD02677720 InChI Key: ASGJFGPILHALRC-UHFFFAOYSA-N Synonym: 3-bromomethyl-5-methylisoxazole,3-bromomethyl-5-methyl-1,2-oxazole,3-bromomethyl-5-methyl-isoxazole,isoxazole,3-bromomethyl-5-methyl,zlchem 1313,acmc-1ca86,3-bromomethyl-5-methylisoxazol,5-brimomethyl-3-methylisoxazle PubChem CID: 2776304 IUPAC Name: 3-(bromomethyl)-5-methyl-1,2-oxazole SMILES: CC1=CC(CBr)=NO1

PubChem CID 2776304
CAS 130628-75-0
Molecular Weight (g/mol) 176.01
MDL Number MFCD02677720
SMILES CC1=CC(CBr)=NO1
Synonym 3-bromomethyl-5-methylisoxazole,3-bromomethyl-5-methyl-1,2-oxazole,3-bromomethyl-5-methyl-isoxazole,isoxazole,3-bromomethyl-5-methyl,zlchem 1313,acmc-1ca86,3-bromomethyl-5-methylisoxazol,5-brimomethyl-3-methylisoxazle
IUPAC Name 3-(bromomethyl)-5-methyl-1,2-oxazole
InChI Key ASGJFGPILHALRC-UHFFFAOYSA-N
Molecular Formula C5H6BrNO
5

1H-Benzotriazol-1-yloxytri(1-pyrrolidinyl)phosphonium hexafluorophosphate, 98%

CAS: 128625-52-5 Molecular Formula: C18H28F6N6OP2 Molecular Weight (g/mol): 520.401 MDL Number: MFCD00077411 InChI Key: VIAFLMPQBHAMLI-UHFFFAOYSA-N Synonym: pybop,1h-benzo d 1,2,3 triazol-1-yl oxy tri pyrrolidin-1-yl phosphonium hexafluorophosphate v,benzotriazol-1-yloxy tripyrrolidinophosphonium hexafluorophosphate,benzotriazole-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,1h-benzotriazol-1-yloxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yloxytris pyrrolidino phosphonium hexafluorophosphate,benzotriazole-1-yl-oxy-tris-pyrrolidino-phosphonium hexafluorophosphate,benzotriazol-1-yl-oxy-tripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinphosphonium hexafluorophosphate PubChem CID: 2724699 IUPAC Name: benzotriazol-1-yloxy(tripyrrolidin-1-yl)phosphanium;hexafluorophosphate SMILES: C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F

PubChem CID 2724699
CAS 128625-52-5
Molecular Weight (g/mol) 520.401
MDL Number MFCD00077411
SMILES C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F
Synonym pybop,1h-benzo d 1,2,3 triazol-1-yl oxy tri pyrrolidin-1-yl phosphonium hexafluorophosphate v,benzotriazol-1-yloxy tripyrrolidinophosphonium hexafluorophosphate,benzotriazole-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinophosphonium hexafluorophosphate,1h-benzotriazol-1-yloxytripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yloxytris pyrrolidino phosphonium hexafluorophosphate,benzotriazole-1-yl-oxy-tris-pyrrolidino-phosphonium hexafluorophosphate,benzotriazol-1-yl-oxy-tripyrrolidinophosphonium hexafluorophosphate,benzotriazol-1-yl-oxytripyrrolidinphosphonium hexafluorophosphate
IUPAC Name benzotriazol-1-yloxy(tripyrrolidin-1-yl)phosphanium;hexafluorophosphate
InChI Key VIAFLMPQBHAMLI-UHFFFAOYSA-N
Molecular Formula C18H28F6N6OP2
6

3-Nitro-1,2,4-triazole, 96%

CAS: 24807-55-4 Molecular Formula: C2H2N4O2 Molecular Weight (g/mol): 114.064 MDL Number: MFCD00009749 InChI Key: KUEFXPHXHHANKS-UHFFFAOYSA-N Synonym: 3-nitro-1,2,4-triazole,3-nitro-1h-1,2,4-triazole,3-nitro-4h-1,2,4-triazole,1h-1,2,4-triazole, 3-nitro,s-triazole, 3-nitro,5-nitro-1h-1,2,4 triazole,3-nitro-1,2,4 triazole,zlchem 554,3-nitro-1,4-triazole PubChem CID: 90614 IUPAC Name: 5-nitro-1H-1,2,4-triazole SMILES: C1=NNC(=N1)[N+](=O)[O-]

PubChem CID 90614
CAS 24807-55-4
Molecular Weight (g/mol) 114.064
MDL Number MFCD00009749
SMILES C1=NNC(=N1)[N+](=O)[O-]
Synonym 3-nitro-1,2,4-triazole,3-nitro-1h-1,2,4-triazole,3-nitro-4h-1,2,4-triazole,1h-1,2,4-triazole, 3-nitro,s-triazole, 3-nitro,5-nitro-1h-1,2,4 triazole,3-nitro-1,2,4 triazole,zlchem 554,3-nitro-1,4-triazole
IUPAC Name 5-nitro-1H-1,2,4-triazole
InChI Key KUEFXPHXHHANKS-UHFFFAOYSA-N
Molecular Formula C2H2N4O2
7

2-Amino-5-methylthiazole, 98%

CAS: 7305-71-7 Molecular Formula: C4H6N2S Molecular Weight (g/mol): 114.17 MDL Number: MFCD00078317 InChI Key: GUABFMPMKJGSBQ-UHFFFAOYSA-N Synonym: 2-amino-5-methylthiazole,5-methylthiazol-2-amine,2-thiazolamine, 5-methyl,2-amino-5-methyl-thiazole,thiazole, 2-amino-5-methyl,5-methyl-2-thiazolamine,5-methyl-2-aminothiazole,unii-7rab78af2p,2-amino-5-methyl thiazole,meloxicam related compound b PubChem CID: 351770 IUPAC Name: 5-methyl-1,3-thiazol-2-amine SMILES: CC1=CN=C(S1)N

PubChem CID 351770
CAS 7305-71-7
Molecular Weight (g/mol) 114.17
MDL Number MFCD00078317
SMILES CC1=CN=C(S1)N
Synonym 2-amino-5-methylthiazole,5-methylthiazol-2-amine,2-thiazolamine, 5-methyl,2-amino-5-methyl-thiazole,thiazole, 2-amino-5-methyl,5-methyl-2-thiazolamine,5-methyl-2-aminothiazole,unii-7rab78af2p,2-amino-5-methyl thiazole,meloxicam related compound b
IUPAC Name 5-methyl-1,3-thiazol-2-amine
InChI Key GUABFMPMKJGSBQ-UHFFFAOYSA-N
Molecular Formula C4H6N2S
8

2,5-Dibromothiazole, 97%

CAS: 4175-78-4 MDL Number: MFCD00016891 InChI Key: XIBIQFJKUZZLLX-UHFFFAOYSA-N Synonym: 2,5-dibromothiazole,thiazole, 2,5-dibromo,2,5-dibormothiazole,thiazole,5-dibromo,2,5-dibromo-thiazole,pubchem20949,acmc-209jlm,ksc237s3r,# PubChem CID: 312394 IUPAC Name: 2,5-dibromo-1,3-thiazole SMILES: C1=C(SC(=N1)Br)Br

PubChem CID 312394
CAS 4175-78-4
MDL Number MFCD00016891
SMILES C1=C(SC(=N1)Br)Br
Synonym 2,5-dibromothiazole,thiazole, 2,5-dibromo,2,5-dibormothiazole,thiazole,5-dibromo,2,5-dibromo-thiazole,pubchem20949,acmc-209jlm,ksc237s3r,#
IUPAC Name 2,5-dibromo-1,3-thiazole
InChI Key XIBIQFJKUZZLLX-UHFFFAOYSA-N
9

2-Amino-4-(2-naphthyl)thiazole, 98%

CAS: 21331-43-1 Molecular Formula: C13H10N2S Molecular Weight (g/mol): 226.297 MDL Number: MFCD00046452 InChI Key: GWDNDNTTXIIXRS-UHFFFAOYSA-N Synonym: 4-naphthalen-2-yl-thiazol-2-ylamine,4-naphthalen-2-yl-1,3-thiazol-2-amine,4-2-naphthyl-1,3-thiazol-2-amine,2-amino-4-2-naphthyl thiazole,4-naphthalen-2-yl thiazol-2-amine,4-naphthalen-2-yl-thiazol-2-yl-amine,4-2-naphthalenyl-2-thiazolamine,2-thiazolamine,4-2-naphthalenyl,4-2-naphthyl-1,3-thiazole-2-ylamine,acmc-20ao57 PubChem CID: 673702 IUPAC Name: 4-naphthalen-2-yl-1,3-thiazol-2-amine SMILES: C1=CC=C2C=C(C=CC2=C1)C3=CSC(=N3)N

PubChem CID 673702
CAS 21331-43-1
Molecular Weight (g/mol) 226.297
MDL Number MFCD00046452
SMILES C1=CC=C2C=C(C=CC2=C1)C3=CSC(=N3)N
Synonym 4-naphthalen-2-yl-thiazol-2-ylamine,4-naphthalen-2-yl-1,3-thiazol-2-amine,4-2-naphthyl-1,3-thiazol-2-amine,2-amino-4-2-naphthyl thiazole,4-naphthalen-2-yl thiazol-2-amine,4-naphthalen-2-yl-thiazol-2-yl-amine,4-2-naphthalenyl-2-thiazolamine,2-thiazolamine,4-2-naphthalenyl,4-2-naphthyl-1,3-thiazole-2-ylamine,acmc-20ao57
IUPAC Name 4-naphthalen-2-yl-1,3-thiazol-2-amine
InChI Key GWDNDNTTXIIXRS-UHFFFAOYSA-N
Molecular Formula C13H10N2S
10

5-Methyl-2-(tri-n-butylstannyl)thiazole, 90+%

CAS: 848613-91-2 Molecular Formula: C16H31NSSn Molecular Weight (g/mol): 388.201 MDL Number: MFCD09025809 InChI Key: LALGELPHLJBAEK-UHFFFAOYSA-N Synonym: 5-methyl-2-tributylstannyl thiazole,5-methyl-2-tributylstannyl-1,3-thiazole,5-methyl-2-tri-n-butylstannyl thiazole,acmc-209px3,5-methyl-2-tributylstannyl-thiazole,thiazole, 5-methyl-2-tributylstannyl,5-methyl-2-tributylstannanyl-thiazole,5-methyl-2-tributylstannanyl-1,3-thiazole,2-tri-n-butylstannyl-5-methylthiazole PubChem CID: 16427131 IUPAC Name: tributyl-(5-methyl-1,3-thiazol-2-yl)stannane SMILES: CCCC[Sn](CCCC)(CCCC)C1=NC=C(S1)C

PubChem CID 16427131
CAS 848613-91-2
Molecular Weight (g/mol) 388.201
MDL Number MFCD09025809
SMILES CCCC[Sn](CCCC)(CCCC)C1=NC=C(S1)C
Synonym 5-methyl-2-tributylstannyl thiazole,5-methyl-2-tributylstannyl-1,3-thiazole,5-methyl-2-tri-n-butylstannyl thiazole,acmc-209px3,5-methyl-2-tributylstannyl-thiazole,thiazole, 5-methyl-2-tributylstannyl,5-methyl-2-tributylstannanyl-thiazole,5-methyl-2-tributylstannanyl-1,3-thiazole,2-tri-n-butylstannyl-5-methylthiazole
IUPAC Name tributyl-(5-methyl-1,3-thiazol-2-yl)stannane
InChI Key LALGELPHLJBAEK-UHFFFAOYSA-N
Molecular Formula C16H31NSSn
11

Methyl thiazole-2-carboxylate, 95%

CAS: 55842-56-3 Molecular Formula: C5H5NO2S Molecular Weight (g/mol): 143.16 MDL Number: MFCD18075580 InChI Key: YRMZUOPMHMPNPG-UHFFFAOYSA-N PubChem CID: 7567660 IUPAC Name: methyl 1,3-thiazole-2-carboxylate SMILES: COC(=O)C1=NC=CS1

PubChem CID 7567660
CAS 55842-56-3
Molecular Weight (g/mol) 143.16
MDL Number MFCD18075580
SMILES COC(=O)C1=NC=CS1
IUPAC Name methyl 1,3-thiazole-2-carboxylate
InChI Key YRMZUOPMHMPNPG-UHFFFAOYSA-N
Molecular Formula C5H5NO2S
12

2-Bromo-5-methylthiazole, 98%

CAS: 41731-23-1 Molecular Formula: C4H4BrNS Molecular Weight (g/mol): 178.047 MDL Number: MFCD08460610 InChI Key: FJPZHYAYNAUKKA-UHFFFAOYSA-N Synonym: 2-bromo-5-methylthiazole,2-bromo-5-methyl-thiazole,thiazole, 2-bromo-5-methyl,pubchem20436,acmc-209jlg,2-bromo-5-methyl thiazole,ksc493s9j PubChem CID: 21906106 IUPAC Name: 2-bromo-5-methyl-1,3-thiazole SMILES: CC1=CN=C(S1)Br

PubChem CID 21906106
CAS 41731-23-1
Molecular Weight (g/mol) 178.047
MDL Number MFCD08460610
SMILES CC1=CN=C(S1)Br
Synonym 2-bromo-5-methylthiazole,2-bromo-5-methyl-thiazole,thiazole, 2-bromo-5-methyl,pubchem20436,acmc-209jlg,2-bromo-5-methyl thiazole,ksc493s9j
IUPAC Name 2-bromo-5-methyl-1,3-thiazole
InChI Key FJPZHYAYNAUKKA-UHFFFAOYSA-N
Molecular Formula C4H4BrNS
13

2-Amino-4-methylthiazole, 98+%

CAS: 1603-91-4 Molecular Formula: C4H6N2S Molecular Weight (g/mol): 114.166 MDL Number: MFCD00005329 InChI Key: OUQMXTJYCAJLGO-UHFFFAOYSA-N Synonym: 2-amino-4-methylthiazole,4-methylthiazol-2-amine,2-thiazolamine, 4-methyl,2-amino-4-methylthiazol,4-methyl-2-thiazolamine,4-methyl-2-thiazolylamine,2-amino-4-methyl-1,3-thiazole,normotiroide,thiazole, 2-amino-4-methyl,4-methyl-2-aminothiazole PubChem CID: 74143 ChEBI: CHEBI:39753 IUPAC Name: 4-methyl-1,3-thiazol-2-amine SMILES: CC1=CSC(=N1)N

PubChem CID 74143
CAS 1603-91-4
Molecular Weight (g/mol) 114.166
ChEBI CHEBI:39753
MDL Number MFCD00005329
SMILES CC1=CSC(=N1)N
Synonym 2-amino-4-methylthiazole,4-methylthiazol-2-amine,2-thiazolamine, 4-methyl,2-amino-4-methylthiazol,4-methyl-2-thiazolamine,4-methyl-2-thiazolylamine,2-amino-4-methyl-1,3-thiazole,normotiroide,thiazole, 2-amino-4-methyl,4-methyl-2-aminothiazole
IUPAC Name 4-methyl-1,3-thiazol-2-amine
InChI Key OUQMXTJYCAJLGO-UHFFFAOYSA-N
Molecular Formula C4H6N2S
14

2-Bromo-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-1-ethanone, 95%, Thermo Scientific™

CAS: 7520-95-8 Molecular Formula: C12H10BrNOS Molecular Weight (g/mol): 296.182 MDL Number: MFCD04071443 InChI Key: BOMSILGSXFNLJX-UHFFFAOYSA-N Synonym: 2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl-1-ethanone,2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl ethanone,5-bromoacetyl-4-methyl-2-phenylthiazole,2-bromo-1-4-methyl-2-phenylthiazol-5-yl ethanone,2-bromo-1-4-methyl-2-phenyl 1,3-thiazol-5-yl ethan-1-one PubChem CID: 2795492 IUPAC Name: 2-bromo-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethanone SMILES: CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)CBr

PubChem CID 2795492
CAS 7520-95-8
Molecular Weight (g/mol) 296.182
MDL Number MFCD04071443
SMILES CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)CBr
Synonym 2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl-1-ethanone,2-bromo-1-4-methyl-2-phenyl-1,3-thiazol-5-yl ethanone,5-bromoacetyl-4-methyl-2-phenylthiazole,2-bromo-1-4-methyl-2-phenylthiazol-5-yl ethanone,2-bromo-1-4-methyl-2-phenyl 1,3-thiazol-5-yl ethan-1-one
IUPAC Name 2-bromo-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)ethanone
InChI Key BOMSILGSXFNLJX-UHFFFAOYSA-N
Molecular Formula C12H10BrNOS
15

2,4-Dimethylthiazole, 99%

CAS: 541-58-2 Molecular Formula: C5H7NS Molecular Weight (g/mol): 113.18 MDL Number: MFCD00014509 InChI Key: OBSLLHNATPQFMJ-UHFFFAOYSA-N Synonym: 2,4-dimethylthiazole,thiazole, 2,4-dimethyl,2,4-methylthiazole,2,4-dimethyl thiazole,unii-lht97038oa,2,4-dimethyl-thiazole,dimethylthiazol,zlchem 533,2,4 dimethylthiazole,2.4-dimethylthiazole PubChem CID: 10934 IUPAC Name: 2,4-dimethyl-1,3-thiazole SMILES: CC1=NC(C)=CS1

PubChem CID 10934
CAS 541-58-2
Molecular Weight (g/mol) 113.18
MDL Number MFCD00014509
SMILES CC1=NC(C)=CS1
Synonym 2,4-dimethylthiazole,thiazole, 2,4-dimethyl,2,4-methylthiazole,2,4-dimethyl thiazole,unii-lht97038oa,2,4-dimethyl-thiazole,dimethylthiazol,zlchem 533,2,4 dimethylthiazole,2.4-dimethylthiazole
IUPAC Name 2,4-dimethyl-1,3-thiazole
InChI Key OBSLLHNATPQFMJ-UHFFFAOYSA-N
Molecular Formula C5H7NS