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Azolines

Organic heterocyclic compounds that consist of a five-membered ring made up of four carbon atoms and one nitrogen atom, and only one carbon - carbon double bond.
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1

Thermo Scientific Chemicals Irbesartan

CAS: 138402-11-6 Formule moléculaire: C25H28N6O Poids moléculaire (g/mol): 428.54 Clé InChI: YOSHYTLCDANDAN-UHFFFAOYSA-N Nom IUPAC: 2-butyl-3-{[2'-(2H-1,2,3,4-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl]methyl}-1,3-diazaspiro[4.4]non-1-en-4-one SMILES: CCCCC1=NC2(CCCC2)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1

Poids moléculaire (g/mol) 428.54
CAS 138402-11-6
Nom IUPAC 2-butyl-3-{[2'-(2H-1,2,3,4-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl]methyl}-1,3-diazaspiro[4.4]non-1-en-4-one
Clé InChI YOSHYTLCDANDAN-UHFFFAOYSA-N
SMILES CCCCC1=NC2(CCCC2)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1
Formule moléculaire C25H28N6O
2

2-Oxazolidone, 98%

CAS: 497-25-6 Formule moléculaire: C3H5NO2 Poids moléculaire (g/mol): 87.08 Numéro MDL: MFCD00005268 Clé InChI: IZXIZTKNFFYFOF-UHFFFAOYSA-N Synonyme: 2-oxazolidone,oxazolidin-2-one,2-oxazolidinone,oxazolidinone,oxazolidone,oxazolidinones,unii-z4d49w92pp,carbamic acid, 2-hydroxyethyl-, gamma-lactone,wln: t5mvotj,carbamic acid, .gamma.-lactone CID PubChem: 73949 ChEBI: CHEBI:1237 Nom IUPAC: 1,3-oxazolidin-2-one SMILES: O=C1NCCO1

Poids moléculaire (g/mol) 87.08
Synonyme 2-oxazolidone,oxazolidin-2-one,2-oxazolidinone,oxazolidinone,oxazolidone,oxazolidinones,unii-z4d49w92pp,carbamic acid, 2-hydroxyethyl-, gamma-lactone,wln: t5mvotj,carbamic acid, .gamma.-lactone
Numéro MDL MFCD00005268
CAS 497-25-6
CID PubChem 73949
ChEBI CHEBI:1237
Nom IUPAC 1,3-oxazolidin-2-one
Clé InChI IZXIZTKNFFYFOF-UHFFFAOYSA-N
SMILES O=C1NCCO1
Formule moléculaire C3H5NO2
3

Creatinine, 98%

CAS: 60-27-5 Formule moléculaire: C4H7N3O Poids moléculaire (g/mol): 113.12 Clé InChI: DDRJAANPRJIHGJ-UHFFFAOYSA-N Synonyme: creatinine,2-imino-1-methylimidazolidin-4-one,1-methylglycocyamidine,1-methylhydantoin-2-imide,creatinine,heated,4h-imidazol-4-one, 2-amino-1,5-dihydro-1-methyl,2-amino-1-methylimidazolin-4-one,creatinina,kreatinin,unii-ayi8ex34eu CID PubChem: 588 ChEBI: CHEBI:16737 Nom IUPAC: 2-amino-3-methyl-4H-imidazol-5-one SMILES: CN1CC(=O)N=C1N

Poids moléculaire (g/mol) 113.12
Synonyme creatinine,2-imino-1-methylimidazolidin-4-one,1-methylglycocyamidine,1-methylhydantoin-2-imide,creatinine,heated,4h-imidazol-4-one, 2-amino-1,5-dihydro-1-methyl,2-amino-1-methylimidazolin-4-one,creatinina,kreatinin,unii-ayi8ex34eu
CAS 60-27-5
CID PubChem 588
ChEBI CHEBI:16737
Nom IUPAC 2-amino-3-methyl-4H-imidazol-5-one
Clé InChI DDRJAANPRJIHGJ-UHFFFAOYSA-N
SMILES CN1CC(=O)N=C1N
Formule moléculaire C4H7N3O
4

2-Ethyl-2-oxazoline, 99+%

CAS: 10431-98-8 Formule moléculaire: C5H9NO Poids moléculaire (g/mol): 99.13 Numéro MDL: MFCD00005302 Clé InChI: NYEZZYQZRQDLEH-UHFFFAOYSA-N Synonyme: 2-ethyl-2-oxazoline,2-ethyloxazoline,2-ethyl-4,5-dihydrooxazole,oxazole, 2-ethyl-4,5-dihydro,2-oxazoline, 2-ethyl,unii-b8cd92t4p5,unii-jm7uh9q3yn,unii-hnx7574gtx,unii-s5dpg6k67i,ethyl oxazoline CID PubChem: 66412 Nom IUPAC: 2-ethyl-4,5-dihydro-1,3-oxazole SMILES: CCC1=NCCO1

Poids moléculaire (g/mol) 99.13
Synonyme 2-ethyl-2-oxazoline,2-ethyloxazoline,2-ethyl-4,5-dihydrooxazole,oxazole, 2-ethyl-4,5-dihydro,2-oxazoline, 2-ethyl,unii-b8cd92t4p5,unii-jm7uh9q3yn,unii-hnx7574gtx,unii-s5dpg6k67i,ethyl oxazoline
Numéro MDL MFCD00005302
CAS 10431-98-8
CID PubChem 66412
Nom IUPAC 2-ethyl-4,5-dihydro-1,3-oxazole
Clé InChI NYEZZYQZRQDLEH-UHFFFAOYSA-N
SMILES CCC1=NCCO1
Formule moléculaire C5H9NO
5

2-Amino-5-bromothiazole monohydrobromide, 95%

CAS: 61296-22-8 Formule moléculaire: C3H3BrN2S·HBr Poids moléculaire (g/mol): 259.95 Numéro MDL: MFCD00012712 Clé InChI: NUSVDASTCPBUIP-UHFFFAOYSA-N Synonyme: 2-amino-5-bromothiazole hydrobromide,2-amino-5-bromothiazole monohydrobromide,5-bromothiazol-2-amine hydrobromide,5-bromo-1,3-thiazol-2-amine hydrobromide,5-bromo-thiazol-2-ylamine hydrobromide,2-amino-5-bromothiazole hbr,2-amino-5-bromo-1,3-thiazole hydrobromide,2-thiazolamine, 5-bromo-, monohydrobromide,5-bromo-1,3-thiazole-2-ylamine, bromide,acmc-209mr7 CID PubChem: 2723848 Nom IUPAC: 5-bromo-1,3-thiazol-2-amine;hydrobromide SMILES: C1=C(SC(=N1)N)Br.Br

Poids moléculaire (g/mol) 259.95
Synonyme 2-amino-5-bromothiazole hydrobromide,2-amino-5-bromothiazole monohydrobromide,5-bromothiazol-2-amine hydrobromide,5-bromo-1,3-thiazol-2-amine hydrobromide,5-bromo-thiazol-2-ylamine hydrobromide,2-amino-5-bromothiazole hbr,2-amino-5-bromo-1,3-thiazole hydrobromide,2-thiazolamine, 5-bromo-, monohydrobromide,5-bromo-1,3-thiazole-2-ylamine, bromide,acmc-209mr7
Numéro MDL MFCD00012712
CAS 61296-22-8
CID PubChem 2723848
Nom IUPAC 5-bromo-1,3-thiazol-2-amine;hydrobromide
Clé InChI NUSVDASTCPBUIP-UHFFFAOYSA-N
SMILES C1=C(SC(=N1)N)Br.Br
Formule moléculaire C3H3BrN2S·HBr
6

2-Mercaptobenzimidazole, 98%

CAS: 583-39-1 Formule moléculaire: C7H6N2S Poids moléculaire (g/mol): 150.20 Numéro MDL: MFCD00466107 Clé InChI: YHMYGUUIMTVXNW-UHFFFAOYSA-N Synonyme: 2-mercaptobenzimidazole,1h-benzoimidazole-2-thiol,2-benzimidazolethiol,1h-benzimidazole-2-thiol,1h-benzo d imidazole-2-thiol,o-phenylenethiourea,antioxidant mb,mercaptobenzimidazole,2-mercaptobenzoimidazole,antiegene mb CID PubChem: 707035 SMILES: S=C1NC2=CC=CC=C2N1

Poids moléculaire (g/mol) 150.20
Synonyme 2-mercaptobenzimidazole,1h-benzoimidazole-2-thiol,2-benzimidazolethiol,1h-benzimidazole-2-thiol,1h-benzo d imidazole-2-thiol,o-phenylenethiourea,antioxidant mb,mercaptobenzimidazole,2-mercaptobenzoimidazole,antiegene mb
Numéro MDL MFCD00466107
CAS 583-39-1
CID PubChem 707035
Clé InChI YHMYGUUIMTVXNW-UHFFFAOYSA-N
SMILES S=C1NC2=CC=CC=C2N1
Formule moléculaire C7H6N2S
7

2-Methyl-2-oxazoline, 99%

CAS: 1120-64-5 Formule moléculaire: C4H7NO Poids moléculaire (g/mol): 85.11 Numéro MDL: MFCD00005298 Clé InChI: GUXJXWKCUUWCLX-UHFFFAOYSA-N Synonyme: 2-methyl-2-oxazoline,2-methyloxazoline,2-methyl-4,5-dihydrooxazole,oxazole, 4,5-dihydro-2-methyl,2-methyl-2-oxazolin,2-methyl-1,3-oxazoline,2-oxazoline, 2-methyl,4,5-dihydro-2-methyl-1,3-oxazole,poly 2-methyl-2-oxazoline,methyl oxazoline CID PubChem: 70713 ChEBI: CHEBI:53614 Nom IUPAC: 2-methyl-4,5-dihydro-1,3-oxazole SMILES: CC1=NCCO1

Poids moléculaire (g/mol) 85.11
Synonyme 2-methyl-2-oxazoline,2-methyloxazoline,2-methyl-4,5-dihydrooxazole,oxazole, 4,5-dihydro-2-methyl,2-methyl-2-oxazolin,2-methyl-1,3-oxazoline,2-oxazoline, 2-methyl,4,5-dihydro-2-methyl-1,3-oxazole,poly 2-methyl-2-oxazoline,methyl oxazoline
Numéro MDL MFCD00005298
CAS 1120-64-5
CID PubChem 70713
ChEBI CHEBI:53614
Nom IUPAC 2-methyl-4,5-dihydro-1,3-oxazole
Clé InChI GUXJXWKCUUWCLX-UHFFFAOYSA-N
SMILES CC1=NCCO1
Formule moléculaire C4H7NO
8

3-Phenyl-1,2,4-triazole-5-thiol hydrate, 98%

CAS: 3414-94-6 Formule moléculaire: C8H7N3S Poids moléculaire (g/mol): 177.23 Numéro MDL: MFCD00051814 Clé InChI: JRLMMJNORORYPO-UHFFFAOYSA-N Synonyme: 5-phenyl-4h-1,2,4-triazole-3-thiol,5-phenyl-1h-1,2,4-triazole-3-thiol,3-phenyl-1h-1,2,4-triazole-5-thiol,3-phenyl-1,2,4-triazole-5-thiol,5-phenyl-s-triazole-3-thiol,5-phenyl-4h-1,2,4-triazol-3-yl hydrosulfide,1h-1,2,4-triazole-3-thiol, 5-phenyl,1,4-dihydro-5-phenyl-3h-1,2,4-triazole-3-thione,2-fenil-5-mercapto-1,3,4-triazolo italian,3h-1,2,4-triazole-3-thione, 1,4-dihydro-5-phenyl CID PubChem: 698268 Nom IUPAC: 5-phenyl-1,2-dihydro-1,2,4-triazole-3-thione SMILES: S=C1NNC(=N1)C1=CC=CC=C1

Poids moléculaire (g/mol) 177.23
Synonyme 5-phenyl-4h-1,2,4-triazole-3-thiol,5-phenyl-1h-1,2,4-triazole-3-thiol,3-phenyl-1h-1,2,4-triazole-5-thiol,3-phenyl-1,2,4-triazole-5-thiol,5-phenyl-s-triazole-3-thiol,5-phenyl-4h-1,2,4-triazol-3-yl hydrosulfide,1h-1,2,4-triazole-3-thiol, 5-phenyl,1,4-dihydro-5-phenyl-3h-1,2,4-triazole-3-thione,2-fenil-5-mercapto-1,3,4-triazolo italian,3h-1,2,4-triazole-3-thione, 1,4-dihydro-5-phenyl
Numéro MDL MFCD00051814
CAS 3414-94-6
CID PubChem 698268
Nom IUPAC 5-phenyl-1,2-dihydro-1,2,4-triazole-3-thione
Clé InChI JRLMMJNORORYPO-UHFFFAOYSA-N
SMILES S=C1NNC(=N1)C1=CC=CC=C1
Formule moléculaire C8H7N3S
9

3-(4,4-Dimethyl-2-oxazolinyl)pyridine, 97%

CAS: 68981-86-2 Formule moléculaire: C10H12N2O Poids moléculaire (g/mol): 176.219 Numéro MDL: MFCD01313220 Clé InChI: XYABHURTMBEOGW-UHFFFAOYSA-N Synonyme: 4,5-dihydro-4,4-dimethyl-2-3-pyridyl oxazole,3-4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl pyridine,4,5-dihydro-4,4-dimethyl-2-pyrid-3-yl oxazole,4,4-dimethyl-2-pyridin-3-yl-4,5-dihydrooxazole,3-4,4-dimethyl-5h-1,3-oxazol-2-yl pyridine,4,4-dimethyl-2-3-pyridyl-1,3-oxazoline,pubchem8698,3-4,4-dimethyl-2-oxazolinyl pyridine,4,4-dimethyl-2-3-pyridyl-oxazoline,4,4-dimethyl-2-3-pyridinyl-5h-oxazole CID PubChem: 2736129 Nom IUPAC: 4,4-dimethyl-2-pyridin-3-yl-5H-1,3-oxazole SMILES: CC1(COC(=N1)C2=CN=CC=C2)C

Poids moléculaire (g/mol) 176.219
Synonyme 4,5-dihydro-4,4-dimethyl-2-3-pyridyl oxazole,3-4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl pyridine,4,5-dihydro-4,4-dimethyl-2-pyrid-3-yl oxazole,4,4-dimethyl-2-pyridin-3-yl-4,5-dihydrooxazole,3-4,4-dimethyl-5h-1,3-oxazol-2-yl pyridine,4,4-dimethyl-2-3-pyridyl-1,3-oxazoline,pubchem8698,3-4,4-dimethyl-2-oxazolinyl pyridine,4,4-dimethyl-2-3-pyridyl-oxazoline,4,4-dimethyl-2-3-pyridinyl-5h-oxazole
Numéro MDL MFCD01313220
CAS 68981-86-2
CID PubChem 2736129
Nom IUPAC 4,4-dimethyl-2-pyridin-3-yl-5H-1,3-oxazole
Clé InChI XYABHURTMBEOGW-UHFFFAOYSA-N
SMILES CC1(COC(=N1)C2=CN=CC=C2)C
Formule moléculaire C10H12N2O
10

5-Chloro-2-mercaptobenzimidazole, 98%

CAS: 25369-78-2 Formule moléculaire: C7H5ClN2S Poids moléculaire (g/mol): 184.641 Numéro MDL: MFCD01658762 Clé InChI: ZZIHEYOZBRPWMB-UHFFFAOYSA-N Synonyme: 5-chloro-2-mercaptobenzimidazole,6-chloro-1h-benzimidazole-2-thiol,5-chloro-2-benzimidazolethiol,2-benzimidazolinethione, 5-chloro,5-chloro-1,3-dihydro-2h-benzimidazole-2-thione,5-chloro-1h-benzimidazole-2-thiol,2-benzimidazolethiol, 5-chloro,5-chloro-2 3-benzimidazolethione,6-chloro-1h-benzoimidazole-2-thiol,6-chloro-1h-benzo d imidazole-2-thiol CID PubChem: 2056429 Nom IUPAC: 5-chloro-1,3-dihydrobenzimidazole-2-thione SMILES: C1=CC2=C(C=C1Cl)NC(=S)N2

Poids moléculaire (g/mol) 184.641
Synonyme 5-chloro-2-mercaptobenzimidazole,6-chloro-1h-benzimidazole-2-thiol,5-chloro-2-benzimidazolethiol,2-benzimidazolinethione, 5-chloro,5-chloro-1,3-dihydro-2h-benzimidazole-2-thione,5-chloro-1h-benzimidazole-2-thiol,2-benzimidazolethiol, 5-chloro,5-chloro-2 3-benzimidazolethione,6-chloro-1h-benzoimidazole-2-thiol,6-chloro-1h-benzo d imidazole-2-thiol
Numéro MDL MFCD01658762
CAS 25369-78-2
CID PubChem 2056429
Nom IUPAC 5-chloro-1,3-dihydrobenzimidazole-2-thione
Clé InChI ZZIHEYOZBRPWMB-UHFFFAOYSA-N
SMILES C1=CC2=C(C=C1Cl)NC(=S)N2
Formule moléculaire C7H5ClN2S
11

2-Mercaptobenzimidazole, 97%

CAS: 583-39-1 Formule moléculaire: C7H6N2S Poids moléculaire (g/mol): 150.20 Numéro MDL: MFCD00466107 Clé InChI: YHMYGUUIMTVXNW-UHFFFAOYSA-N CID PubChem: 707035 SMILES: S=C1NC2=CC=CC=C2N1

Poids moléculaire (g/mol) 150.20
Numéro MDL MFCD00466107
CAS 583-39-1
CID PubChem 707035
Clé InChI YHMYGUUIMTVXNW-UHFFFAOYSA-N
SMILES S=C1NC2=CC=CC=C2N1
Formule moléculaire C7H6N2S
12

Creatinine, 98%

CAS: 60-27-5 Formule moléculaire: C4H7N3O Poids moléculaire (g/mol): 113.12 Numéro MDL: MFCD00059730 Clé InChI: DDRJAANPRJIHGJ-UHFFFAOYSA-N Synonyme: creatinine,2-imino-1-methylimidazolidin-4-one,1-methylglycocyamidine,1-methylhydantoin-2-imide,creatinine,heated,4h-imidazol-4-one, 2-amino-1,5-dihydro-1-methyl,2-amino-1-methylimidazolin-4-one,creatinina,kreatinin,unii-ayi8ex34eu CID PubChem: 588 ChEBI: CHEBI:16737 Nom IUPAC: 2-amino-3-methyl-4H-imidazol-5-one SMILES: CN1CC(=O)N=C1N

Poids moléculaire (g/mol) 113.12
Synonyme creatinine,2-imino-1-methylimidazolidin-4-one,1-methylglycocyamidine,1-methylhydantoin-2-imide,creatinine,heated,4h-imidazol-4-one, 2-amino-1,5-dihydro-1-methyl,2-amino-1-methylimidazolin-4-one,creatinina,kreatinin,unii-ayi8ex34eu
Numéro MDL MFCD00059730
CAS 60-27-5
CID PubChem 588
ChEBI CHEBI:16737
Nom IUPAC 2-amino-3-methyl-4H-imidazol-5-one
Clé InChI DDRJAANPRJIHGJ-UHFFFAOYSA-N
SMILES CN1CC(=O)N=C1N
Formule moléculaire C4H7N3O
13

2-Oxazolidinone, 99%

CAS: 497-25-6 Formule moléculaire: C3H5NO2 Poids moléculaire (g/mol): 87.08 Numéro MDL: MFCD00005268 Clé InChI: IZXIZTKNFFYFOF-UHFFFAOYSA-N Synonyme: 2-oxazolidone,oxazolidin-2-one,2-oxazolidinone,oxazolidinone,oxazolidone,oxazolidinones,unii-z4d49w92pp,carbamic acid, 2-hydroxyethyl-, gamma-lactone,wln: t5mvotj,carbamic acid, .gamma.-lactone CID PubChem: 73949 ChEBI: CHEBI:1237 Nom IUPAC: 1,3-oxazolidin-2-one SMILES: O=C1NCCO1

Poids moléculaire (g/mol) 87.08
Synonyme 2-oxazolidone,oxazolidin-2-one,2-oxazolidinone,oxazolidinone,oxazolidone,oxazolidinones,unii-z4d49w92pp,carbamic acid, 2-hydroxyethyl-, gamma-lactone,wln: t5mvotj,carbamic acid, .gamma.-lactone
Numéro MDL MFCD00005268
CAS 497-25-6
CID PubChem 73949
ChEBI CHEBI:1237
Nom IUPAC 1,3-oxazolidin-2-one
Clé InChI IZXIZTKNFFYFOF-UHFFFAOYSA-N
SMILES O=C1NCCO1
Formule moléculaire C3H5NO2
14

2-Mercapto-1-methylimidazole, 98%

CAS: 60-56-0 Formule moléculaire: C4H6N2S Poids moléculaire (g/mol): 114.17 Numéro MDL: MFCD00179321 Clé InChI: PMRYVIKBURPHAH-UHFFFAOYSA-N Synonyme: methimazole,thiamazole,2-mercapto-1-methylimidazole,tapazole,mercazolyl,1-methylimidazole-2-thiol,mercazole,metazolo,methimazol,thiamazol CID PubChem: 1349907 ChEBI: CHEBI:50673 Nom IUPAC: 3-methyl-1H-imidazole-2-thione SMILES: CN1C=CNC1=S

Poids moléculaire (g/mol) 114.17
Synonyme methimazole,thiamazole,2-mercapto-1-methylimidazole,tapazole,mercazolyl,1-methylimidazole-2-thiol,mercazole,metazolo,methimazol,thiamazol
Numéro MDL MFCD00179321
CAS 60-56-0
CID PubChem 1349907
ChEBI CHEBI:50673
Nom IUPAC 3-methyl-1H-imidazole-2-thione
Clé InChI PMRYVIKBURPHAH-UHFFFAOYSA-N
SMILES CN1C=CNC1=S
Formule moléculaire C4H6N2S
15

Serotonin creatinine sulfate monohydrate, 99%

CAS: 61-47-2 Formule moléculaire: H2SO4·H2O Poids moléculaire (g/mol): 405.42 Numéro MDL: MFCD00149653 Clé InChI: BKCXVJIGPVULPX-UHFFFAOYSA-N Synonyme: serotonin creatinine sulfate monohydrate,serotonin creatinin-sulfat-1-wasser,unii-6l522laq9u,serotonin creatine sulfate monohydrate,creatinina serotonin sulfuric acid hydrate,1-benzo b thien-3-yl-3-1-pyrrolidinyl-1-propanone hydrochloride,1-propanone, 1-benzo b thien-3-yl-3-1-pyrrolidinyl-, hydrochloride,sulfuric acid compound with 2-imino-1-methylimidazolidin-4-one and 3-2-aminoethyl-1h-indol-5-ol 1:1:1 hydrate,ccris 8960,serotonincreatininesulfatemonohydrate CID PubChem: 164531 Nom IUPAC: 3-(2-aminoethyl)-1H-indol-5-ol;2-amino-3-methyl-4H-imidazol-5-one;sulfuric acid;hydrate SMILES: CN1CC(=O)N=C1N.C1=CC2=C(C=C1O)C(=CN2)CCN.O.OS(=O)(=O)O

Poids moléculaire (g/mol) 405.42
Synonyme serotonin creatinine sulfate monohydrate,serotonin creatinin-sulfat-1-wasser,unii-6l522laq9u,serotonin creatine sulfate monohydrate,creatinina serotonin sulfuric acid hydrate,1-benzo b thien-3-yl-3-1-pyrrolidinyl-1-propanone hydrochloride,1-propanone, 1-benzo b thien-3-yl-3-1-pyrrolidinyl-, hydrochloride,sulfuric acid compound with 2-imino-1-methylimidazolidin-4-one and 3-2-aminoethyl-1h-indol-5-ol 1:1:1 hydrate,ccris 8960,serotonincreatininesulfatemonohydrate
Numéro MDL MFCD00149653
CAS 61-47-2
CID PubChem 164531
Nom IUPAC 3-(2-aminoethyl)-1H-indol-5-ol;2-amino-3-methyl-4H-imidazol-5-one;sulfuric acid;hydrate
Clé InChI BKCXVJIGPVULPX-UHFFFAOYSA-N
SMILES CN1CC(=O)N=C1N.C1=CC2=C(C=C1O)C(=CN2)CCN.O.OS(=O)(=O)O
Formule moléculaire H2SO4·H2O