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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)
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1 – 15 of 906 results
1

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
2

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
3

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
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
6

5-(2-Methyl-1,3-thiazol-4-yl)thiophene-2-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 215434-25-6 Molecular Formula: C8H6ClNO2S3 Molecular Weight (g/mol): 279.771 InChI Key: YIKNRCVJBOLZFL-UHFFFAOYSA-N Synonym: 5-2-methyl-1,3-thiazol-4-yl thiophene-2-sulfonyl chloride,5-2-methylthiazol-4-yl thiophene-2-sulfonyl chloride,2-thiophenesulfonylchloride, 5-2-methyl-4-thiazolyl,5-2-methylthiazol-4-yl thiophene-2-sulphonyl chloride,5-2-methyl-1,3-thiazol-4-yl thiophene-2-sulfonylchloride,5-2-methylthiazol-4-yl thiophene-2-sulfonylchloride,5-2-methylthiazol-4-yl thiophene-2-sulphonylchloride,5-2-methyl-thiazol-4-yl-thiophene-2-sulfonyl chloride,5-2-methyl-1,3-thiazol-4-yl-2-thiophenesulfonyl chloride,chloro 5-2-methyl 1,3-thiazol-4-yl 2-thienyl sulfone PubChem CID: 2736979 IUPAC Name: 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-sulfonyl chloride SMILES: CC1=NC(=CS1)C2=CC=C(S2)S(=O)(=O)Cl

PubChem CID 2736979
CAS 215434-25-6
Molecular Weight (g/mol) 279.771
SMILES CC1=NC(=CS1)C2=CC=C(S2)S(=O)(=O)Cl
Synonym 5-2-methyl-1,3-thiazol-4-yl thiophene-2-sulfonyl chloride,5-2-methylthiazol-4-yl thiophene-2-sulfonyl chloride,2-thiophenesulfonylchloride, 5-2-methyl-4-thiazolyl,5-2-methylthiazol-4-yl thiophene-2-sulphonyl chloride,5-2-methyl-1,3-thiazol-4-yl thiophene-2-sulfonylchloride,5-2-methylthiazol-4-yl thiophene-2-sulfonylchloride,5-2-methylthiazol-4-yl thiophene-2-sulphonylchloride,5-2-methyl-thiazol-4-yl-thiophene-2-sulfonyl chloride,5-2-methyl-1,3-thiazol-4-yl-2-thiophenesulfonyl chloride,chloro 5-2-methyl 1,3-thiazol-4-yl 2-thienyl sulfone
IUPAC Name 5-(2-methyl-1,3-thiazol-4-yl)thiophene-2-sulfonyl chloride
InChI Key YIKNRCVJBOLZFL-UHFFFAOYSA-N
Molecular Formula C8H6ClNO2S3
7

[5-(2-Methyl-1,3-thiazol-4-yl)-2-thienyl]methanol 95%, Thermo Scientific™

CAS: 337508-70-0 Molecular Formula: C9H9NOS2 Molecular Weight (g/mol): 211.297 InChI Key: CQCKNGVVCKWDLF-UHFFFAOYSA-N Synonym: 5-2-methyl-1,3-thiazol-4-yl-2-thienyl methanol,5-2-methyl-1,3-thiazol-4-yl thiophen-2-yl methanol,5-2-methyl-4-thiazolyl thiophene-2-methanol,5-2-methylthiazol-4-yl thiophen-2-yl methanol,5-2-methyl-1,3-thiazol-4-yl thien-2-yl methanol,5-2-methyl-1,3-thiazol-4-yl-2-thienyl methan-1-ol PubChem CID: 2776470 IUPAC Name: [5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methanol SMILES: CC1=NC(=CS1)C2=CC=C(S2)CO

PubChem CID 2776470
CAS 337508-70-0
Molecular Weight (g/mol) 211.297
SMILES CC1=NC(=CS1)C2=CC=C(S2)CO
Synonym 5-2-methyl-1,3-thiazol-4-yl-2-thienyl methanol,5-2-methyl-1,3-thiazol-4-yl thiophen-2-yl methanol,5-2-methyl-4-thiazolyl thiophene-2-methanol,5-2-methylthiazol-4-yl thiophen-2-yl methanol,5-2-methyl-1,3-thiazol-4-yl thien-2-yl methanol,5-2-methyl-1,3-thiazol-4-yl-2-thienyl methan-1-ol
IUPAC Name [5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methanol
InChI Key CQCKNGVVCKWDLF-UHFFFAOYSA-N
Molecular Formula C9H9NOS2
8

4-Methyl-2-(2-pyrazinyl)-1,3-thiazole-5-carboxylic acid, 97%, Thermo Scientific™

CAS: 216959-92-1 Molecular Formula: C9H7N3O2S Molecular Weight (g/mol): 221.23 MDL Number: MFCD00111662 InChI Key: XDZXQDHRHGIPRN-UHFFFAOYSA-N Synonym: 4-methyl-2-2-pyrazinyl-1,3-thiazole-5-carboxylic acid,4-methyl-2-pyrazin-2-yl-1,3-thiazole-5-carboxylic acid,2-5-carboxy-4-methyl-1,3-thiazol-2-yl pyrazine,4-methyl-2-2-pyrazinyl thiazole-5-carboxylic acid,4-methyl-2-2-pyrazinyl-thiazole-5-carboxylic acid,4-methyl-2-pyrazin-2-yl thiazole-5-carboxylic acid,5-carboxy-4-methyl-2-pyrazin-2-yl-1,3-thiazole,5-thiazolecarboxylicacid, 4-methyl-2-2-pyrazinyl,5-thiazolecarboxylic acid, 4-methyl-2-2-pyrazinyl PubChem CID: 2776505 IUPAC Name: 4-methyl-2-pyrazin-2-yl-1,3-thiazole-5-carboxylic acid SMILES: CC1=C(SC(=N1)C1=NC=CN=C1)C(O)=O

PubChem CID 2776505
CAS 216959-92-1
Molecular Weight (g/mol) 221.23
MDL Number MFCD00111662
SMILES CC1=C(SC(=N1)C1=NC=CN=C1)C(O)=O
Synonym 4-methyl-2-2-pyrazinyl-1,3-thiazole-5-carboxylic acid,4-methyl-2-pyrazin-2-yl-1,3-thiazole-5-carboxylic acid,2-5-carboxy-4-methyl-1,3-thiazol-2-yl pyrazine,4-methyl-2-2-pyrazinyl thiazole-5-carboxylic acid,4-methyl-2-2-pyrazinyl-thiazole-5-carboxylic acid,4-methyl-2-pyrazin-2-yl thiazole-5-carboxylic acid,5-carboxy-4-methyl-2-pyrazin-2-yl-1,3-thiazole,5-thiazolecarboxylicacid, 4-methyl-2-2-pyrazinyl,5-thiazolecarboxylic acid, 4-methyl-2-2-pyrazinyl
IUPAC Name 4-methyl-2-pyrazin-2-yl-1,3-thiazole-5-carboxylic acid
InChI Key XDZXQDHRHGIPRN-UHFFFAOYSA-N
Molecular Formula C9H7N3O2S
9

4-(1H-1,2,4-triazol-1-ylmethyl)benzonitrile, ≥97%, Thermo Scientific™

CAS: 112809-25-3 Molecular Formula: C10H8N4 Molecular Weight (g/mol): 184.202 MDL Number: MFCD07368016 InChI Key: HQLYWHSJALKYOV-UHFFFAOYSA-N Synonym: 4-1h-1,2,4-triazol-1-ylmethyl benzonitrile,4-1h-1,2,4-triazol-1-yl methyl benzonitrile,4-1h-1,2,4-triazolylmethyl benzonitrile,4-1,2,4-triazol-1-ylmethyl benzonitrile,benzonitrile, 4-1h-1,2,4-triazol-1-ylmethyl,4-1,2,4-triazol-1-yl methyl benzonitrile,4-1-1,2,4-triazolyl methyl benzontrile,4-1,2,4-triazolylmethyl benzenecarbonitrile,letrozole impurity c PubChem CID: 7537616 IUPAC Name: 4-(1,2,4-triazol-1-ylmethyl)benzonitrile SMILES: C1=CC(=CC=C1CN2C=NC=N2)C#N

PubChem CID 7537616
CAS 112809-25-3
Molecular Weight (g/mol) 184.202
MDL Number MFCD07368016
SMILES C1=CC(=CC=C1CN2C=NC=N2)C#N
Synonym 4-1h-1,2,4-triazol-1-ylmethyl benzonitrile,4-1h-1,2,4-triazol-1-yl methyl benzonitrile,4-1h-1,2,4-triazolylmethyl benzonitrile,4-1,2,4-triazol-1-ylmethyl benzonitrile,benzonitrile, 4-1h-1,2,4-triazol-1-ylmethyl,4-1,2,4-triazol-1-yl methyl benzonitrile,4-1-1,2,4-triazolyl methyl benzontrile,4-1,2,4-triazolylmethyl benzenecarbonitrile,letrozole impurity c
IUPAC Name 4-(1,2,4-triazol-1-ylmethyl)benzonitrile
InChI Key HQLYWHSJALKYOV-UHFFFAOYSA-N
Molecular Formula C10H8N4
10

1-Methyl-1H-pyrazole-3-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 89501-90-6 Molecular Formula: C4H5ClN2O2S Molecular Weight (g/mol): 180.606 MDL Number: MFCD08690273 InChI Key: TWLAHGNFQBQYEL-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-3-sulfonyl chloride,1-methyl-1h-pyrazole-3-sulfonylchloride,1h-pyrazole-3-sulfonyl chloride, 1-methyl,1h-pyrazole-3-sulfonylchloride, 1-methyl,pubchem14132,acmc-209zg6,n-methylpyrazole sulfonyl chloride,chloro 1-methylpyrazol-3-yl sulfone,1-methyl-3-pyrazolesulfonyl chloride,methyl-1-h-pyrazole-3-sulfonyl chloride PubChem CID: 13474466 IUPAC Name: 1-methylpyrazole-3-sulfonyl chloride SMILES: CN1C=CC(=N1)S(=O)(=O)Cl

PubChem CID 13474466
CAS 89501-90-6
Molecular Weight (g/mol) 180.606
MDL Number MFCD08690273
SMILES CN1C=CC(=N1)S(=O)(=O)Cl
Synonym 1-methyl-1h-pyrazole-3-sulfonyl chloride,1-methyl-1h-pyrazole-3-sulfonylchloride,1h-pyrazole-3-sulfonyl chloride, 1-methyl,1h-pyrazole-3-sulfonylchloride, 1-methyl,pubchem14132,acmc-209zg6,n-methylpyrazole sulfonyl chloride,chloro 1-methylpyrazol-3-yl sulfone,1-methyl-3-pyrazolesulfonyl chloride,methyl-1-h-pyrazole-3-sulfonyl chloride
IUPAC Name 1-methylpyrazole-3-sulfonyl chloride
InChI Key TWLAHGNFQBQYEL-UHFFFAOYSA-N
Molecular Formula C4H5ClN2O2S
11

(1-Methyl-1H-pyrazol-3-yl)methanol, 95%, Thermo Scientific™

CAS: 84547-62-6 Molecular Formula: C5H8N2O Molecular Weight (g/mol): 112.132 MDL Number: MFCD08690274 InChI Key: WCKJRVKJTUIAFW-UHFFFAOYSA-N PubChem CID: 12845046 IUPAC Name: (1-methylpyrazol-3-yl)methanol SMILES: CN1C=CC(=N1)CO

PubChem CID 12845046
CAS 84547-62-6
Molecular Weight (g/mol) 112.132
MDL Number MFCD08690274
SMILES CN1C=CC(=N1)CO
IUPAC Name (1-methylpyrazol-3-yl)methanol
InChI Key WCKJRVKJTUIAFW-UHFFFAOYSA-N
Molecular Formula C5H8N2O
12

4-Methyl-2-pyrid-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride, 90%, Thermo Scientific™

CAS: 953408-88-3 Molecular Formula: C10H8Cl2N2OS Molecular Weight (g/mol): 275.147 MDL Number: MFCD09879910 InChI Key: XERFFSPGBNKEDT-UHFFFAOYSA-N Synonym: 4-methyl-2-pyrid-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride-hydrogen chloride 1/1,5-thiazolecarbonylchloride, 4-methyl-2-4-pyridinyl-, hydrochloride 1:1 PubChem CID: 24229588 IUPAC Name: 4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride;hydrochloride SMILES: CC1=C(SC(=N1)C2=CC=NC=C2)C(=O)Cl.Cl

PubChem CID 24229588
CAS 953408-88-3
Molecular Weight (g/mol) 275.147
MDL Number MFCD09879910
SMILES CC1=C(SC(=N1)C2=CC=NC=C2)C(=O)Cl.Cl
Synonym 4-methyl-2-pyrid-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride hydrochloride,4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride-hydrogen chloride 1/1,5-thiazolecarbonylchloride, 4-methyl-2-4-pyridinyl-, hydrochloride 1:1
IUPAC Name 4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride;hydrochloride
InChI Key XERFFSPGBNKEDT-UHFFFAOYSA-N
Molecular Formula C10H8Cl2N2OS
13

5-Methyl-3-phenylisoxazole-4-carbonyl chloride, 90%, Thermo Scientific™

CAS: 16883-16-2 Molecular Formula: C11H8ClNO2 Molecular Weight (g/mol): 221.64 MDL Number: MFCD00052205 InChI Key: HXEVQMXCHCDPSO-UHFFFAOYSA-N Synonym: 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452 PubChem CID: 85624 IUPAC Name: 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl

PubChem CID 85624
CAS 16883-16-2
Molecular Weight (g/mol) 221.64
MDL Number MFCD00052205
SMILES CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl
Synonym 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452
IUPAC Name 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride
InChI Key HXEVQMXCHCDPSO-UHFFFAOYSA-N
Molecular Formula C11H8ClNO2
14

3,5-Dimethyl-4H-1,2,4-triazol-4-amine, 97%, Thermo Scientific™

CAS: 3530-15-2 Molecular Formula: C4H8N4 Molecular Weight (g/mol): 112.136 MDL Number: MFCD00051647 InChI Key: MIIKMZAVLKMOFM-UHFFFAOYSA-N PubChem CID: 229800 IUPAC Name: 3,5-dimethyl-1,2,4-triazol-4-amine SMILES: CC1=NN=C(N1N)C

PubChem CID 229800
CAS 3530-15-2
Molecular Weight (g/mol) 112.136
MDL Number MFCD00051647
SMILES CC1=NN=C(N1N)C
IUPAC Name 3,5-dimethyl-1,2,4-triazol-4-amine
InChI Key MIIKMZAVLKMOFM-UHFFFAOYSA-N
Molecular Formula C4H8N4
15

5-(2-Bromophenyl)-1,3-oxazole, ≥97%, Thermo Scientific™

CAS: 328270-70-8 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 MDL Number: MFCD05668985 InChI Key: JLTHLCLAPCIKJJ-UHFFFAOYSA-N Synonym: 5-2-bromophenyl oxazole,5-2-bromophenyl-1,3-oxazole,oxazole,5-2-bromophenyl PubChem CID: 3780551 IUPAC Name: 5-(2-bromophenyl)-1,3-oxazole SMILES: C1=CC=C(C(=C1)C2=CN=CO2)Br

PubChem CID 3780551
CAS 328270-70-8
Molecular Weight (g/mol) 224.057
MDL Number MFCD05668985
SMILES C1=CC=C(C(=C1)C2=CN=CO2)Br
Synonym 5-2-bromophenyl oxazole,5-2-bromophenyl-1,3-oxazole,oxazole,5-2-bromophenyl
IUPAC Name 5-(2-bromophenyl)-1,3-oxazole
InChI Key JLTHLCLAPCIKJJ-UHFFFAOYSA-N
Molecular Formula C9H6BrNO