Organoheterocyclic compounds
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6-Bromopyridine-2-carboxamide, 97%
CAS: 25194-52-9 Molecular Formula: C6H5BrN2O Molecular Weight (g/mol): 201.02 MDL Number: MFCD00234154 InChI Key: HWRUOHMDYQEWOD-UHFFFAOYSA-N PubChem CID: 21961408 IUPAC Name: 6-bromopyridine-2-carboxamide SMILES: NC(=O)C1=NC(Br)=CC=C1
| PubChem CID | 21961408 |
|---|---|
| CAS | 25194-52-9 |
| Molecular Weight (g/mol) | 201.02 |
| MDL Number | MFCD00234154 |
| SMILES | NC(=O)C1=NC(Br)=CC=C1 |
| IUPAC Name | 6-bromopyridine-2-carboxamide |
| InChI Key | HWRUOHMDYQEWOD-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrN2O |
Papaverine hydrochloride, 99%
CAS: 61-25-6 Molecular Formula: C20H21NO4·ClH Molecular Weight (g/mol): 375.85 MDL Number: MFCD00012745 InChI Key: UOTMYNBWXDUBNX-UHFFFAOYSA-N Synonym: papaverine hydrochloride,cardiospan,cardoverina,dispamil,drapavel,forpavin,papalease,papaversan,pavatest,paverolan PubChem CID: 6084 IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride SMILES: COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl
| PubChem CID | 6084 |
|---|---|
| CAS | 61-25-6 |
| Molecular Weight (g/mol) | 375.85 |
| MDL Number | MFCD00012745 |
| SMILES | COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl |
| Synonym | papaverine hydrochloride,cardiospan,cardoverina,dispamil,drapavel,forpavin,papalease,papaversan,pavatest,paverolan |
| IUPAC Name | 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride |
| InChI Key | UOTMYNBWXDUBNX-UHFFFAOYSA-N |
| Molecular Formula | C20H21NO4·ClH |
Imidazo[2,1-b]thiazole-6-carbaldehyde 97+%, Thermo Scientific™
CAS: 120107-61-1 Molecular Formula: C6H4N2OS Molecular Weight (g/mol): 152.171 InChI Key: VYBDPAAWKNKEKY-UHFFFAOYSA-N Synonym: imidazo 2,1-b thiazole-6-carbaldehyde,imidazo 2,1-b 1,3 thiazole-6-carbaldehyde,imidazo 2,1-b thiazole-6-carboxaldehyde,acmc-20moqu,imidazo 2,1-b 1,3-thiazoline-6-carbaldehyde,imidazo 2,1-b 1,3 thiazole-6-carboxaldehyde,imidazo 2,1-b thiazole-6-carboxaldehydeimidazo PubChem CID: 4961258 IUPAC Name: imidazo[2,1-b][1,3]thiazole-6-carbaldehyde SMILES: C1=CSC2=NC(=CN21)C=O
| PubChem CID | 4961258 |
|---|---|
| CAS | 120107-61-1 |
| Molecular Weight (g/mol) | 152.171 |
| SMILES | C1=CSC2=NC(=CN21)C=O |
| Synonym | imidazo 2,1-b thiazole-6-carbaldehyde,imidazo 2,1-b 1,3 thiazole-6-carbaldehyde,imidazo 2,1-b thiazole-6-carboxaldehyde,acmc-20moqu,imidazo 2,1-b 1,3-thiazoline-6-carbaldehyde,imidazo 2,1-b 1,3 thiazole-6-carboxaldehyde,imidazo 2,1-b thiazole-6-carboxaldehydeimidazo |
| IUPAC Name | imidazo[2,1-b][1,3]thiazole-6-carbaldehyde |
| InChI Key | VYBDPAAWKNKEKY-UHFFFAOYSA-N |
| Molecular Formula | C6H4N2OS |
5-(Methylthio)thiophene-2-carboxylic acid, 97%, Thermo Scientific™
CAS: 20873-58-9 Molecular Formula: C6H6O2S2 Molecular Weight (g/mol): 174.232 MDL Number: MFCD00173742 InChI Key: FWFWUSLBIIIIEN-UHFFFAOYSA-N Synonym: 5-methylthio thiophene-2-carboxylic acid,5-methylsulfanyl thiophene-2-carboxylic acid,2-thiophenecarboxylic acid, 5-methylthio,2-thiophenecarboxylicacid, 5-methylthio,5-methylthiothiophene-2-carboxylic acid,maybridge1_007717,d04ngc,cambridge id 5103856,5-methylmercaptothiophene-2-carboxylic,5-methylthio-2-thiophenecarboxylic acid PubChem CID: 714372 IUPAC Name: 5-methylsulfanylthiophene-2-carboxylic acid SMILES: CSC1=CC=C(S1)C(=O)O
| PubChem CID | 714372 |
|---|---|
| CAS | 20873-58-9 |
| Molecular Weight (g/mol) | 174.232 |
| MDL Number | MFCD00173742 |
| SMILES | CSC1=CC=C(S1)C(=O)O |
| Synonym | 5-methylthio thiophene-2-carboxylic acid,5-methylsulfanyl thiophene-2-carboxylic acid,2-thiophenecarboxylic acid, 5-methylthio,2-thiophenecarboxylicacid, 5-methylthio,5-methylthiothiophene-2-carboxylic acid,maybridge1_007717,d04ngc,cambridge id 5103856,5-methylmercaptothiophene-2-carboxylic,5-methylthio-2-thiophenecarboxylic acid |
| IUPAC Name | 5-methylsulfanylthiophene-2-carboxylic acid |
| InChI Key | FWFWUSLBIIIIEN-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2S2 |
2-Amino-6-methoxypyridine, 97%
CAS: 17920-35-3 Molecular Formula: C6H8N2O Molecular Weight (g/mol): 124.143 MDL Number: MFCD04972542 InChI Key: DEUALFRBMNMGDS-UHFFFAOYSA-N Synonym: 2-amino-6-methoxypyridine,6-methoxy-pyridin-2-ylamine,6-methoxy-2-pyridinamine,6-methoxypyrid-2-ylamine,6-methoxy-2-pyridylamine,2-amino-6-methoxy pyridine,2-pyridinamine, 6-methoxy,methoxypyridin-6-amine,acmc-209efc,6-methoxy-2-aminopyridin PubChem CID: 580053 IUPAC Name: 6-methoxypyridin-2-amine SMILES: COC1=CC=CC(=N1)N
| PubChem CID | 580053 |
|---|---|
| CAS | 17920-35-3 |
| Molecular Weight (g/mol) | 124.143 |
| MDL Number | MFCD04972542 |
| SMILES | COC1=CC=CC(=N1)N |
| Synonym | 2-amino-6-methoxypyridine,6-methoxy-pyridin-2-ylamine,6-methoxy-2-pyridinamine,6-methoxypyrid-2-ylamine,6-methoxy-2-pyridylamine,2-amino-6-methoxy pyridine,2-pyridinamine, 6-methoxy,methoxypyridin-6-amine,acmc-209efc,6-methoxy-2-aminopyridin |
| IUPAC Name | 6-methoxypyridin-2-amine |
| InChI Key | DEUALFRBMNMGDS-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O |
3-Methylisoxazole-5-carboxylic acid, 97%
CAS: 4857-42-5 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 MDL Number: MFCD00464222 InChI Key: HXIYCKAAQPHZBM-UHFFFAOYSA-N Synonym: 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519 PubChem CID: 853085 IUPAC Name: 3-methyl-1,2-oxazole-5-carboxylic acid SMILES: CC1=NOC(=C1)C(=O)O
| PubChem CID | 853085 |
|---|---|
| CAS | 4857-42-5 |
| Molecular Weight (g/mol) | 127.099 |
| MDL Number | MFCD00464222 |
| SMILES | CC1=NOC(=C1)C(=O)O |
| Synonym | 3-methylisoxazole-5-carboxylic acid,3-methyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-methyl,3-methyl-isoxazole-5-carboxylic acid,5-carboxy-3-methylisoxazole,5-isoxazolecarboxylicacid, 3-methyl,3-methylisoxazole-5-carboxylicacid,acmc-1aruu,3-methyl-5-carboxyisoxazole,aronis24519 |
| IUPAC Name | 3-methyl-1,2-oxazole-5-carboxylic acid |
| InChI Key | HXIYCKAAQPHZBM-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO3 |
Azetidine hydrochloride, 97%
CAS: 36520-39-5 Molecular Formula: C3H8ClN Molecular Weight (g/mol): 93.554 MDL Number: MFCD00191762 InChI Key: HGQULGDOROIPJN-UHFFFAOYSA-N Synonym: azetidine hydrochloride,azetidine hcl,trimethyleneimine hydrochloride,azetidine, hydrochloride,azetidinehydrochloride,azetidine-hcl,azetidine hcl salt,azetidine-hydrochloride,azetidine; hydrochloride,acmc-1aiho PubChem CID: 12308726 IUPAC Name: azetidine;hydrochloride SMILES: C1CNC1.Cl
| PubChem CID | 12308726 |
|---|---|
| CAS | 36520-39-5 |
| Molecular Weight (g/mol) | 93.554 |
| MDL Number | MFCD00191762 |
| SMILES | C1CNC1.Cl |
| Synonym | azetidine hydrochloride,azetidine hcl,trimethyleneimine hydrochloride,azetidine, hydrochloride,azetidinehydrochloride,azetidine-hcl,azetidine hcl salt,azetidine-hydrochloride,azetidine; hydrochloride,acmc-1aiho |
| IUPAC Name | azetidine;hydrochloride |
| InChI Key | HGQULGDOROIPJN-UHFFFAOYSA-N |
| Molecular Formula | C3H8ClN |
N-Hydroxysulfosuccinimide sodium salt, 95%
CAS: 106627-54-7 Molecular Formula: C4H4NNaO6S Molecular Weight (g/mol): 217.13 InChI Key: RPENMORRBUTCPR-UHFFFAOYSA-M Synonym: n-hydroxysulfosuccinimide sodium salt,sulfo-nhs,sodium 1-hydroxy-2,5-dioxopyrrolidine-3-sulfonate,n-hydroxysulfosuccinimidesodiumsalt,3-pyrrolidinesulfonic acid, 1-hydroxy-2,5-dioxo-, monosodium salt,sodium 1-hydroxy-2,5-dioxo-pyrrolidine-3-sulfonate,n-hydroxusulfosuccinimide sodium,n-hydroxy-2-sodiosulfo succinimide,n-hydroxysulfosuccinimide,sodium salt,n-hydroxusulfosuccinimide sodium salt PubChem CID: 3520574 IUPAC Name: sodium;1-hydroxy-2,5-dioxopyrrolidine-3-sulfonate SMILES: C1C(C(=O)N(C1=O)O)S(=O)(=O)[O-].[Na+]
| PubChem CID | 3520574 |
|---|---|
| CAS | 106627-54-7 |
| Molecular Weight (g/mol) | 217.13 |
| SMILES | C1C(C(=O)N(C1=O)O)S(=O)(=O)[O-].[Na+] |
| Synonym | n-hydroxysulfosuccinimide sodium salt,sulfo-nhs,sodium 1-hydroxy-2,5-dioxopyrrolidine-3-sulfonate,n-hydroxysulfosuccinimidesodiumsalt,3-pyrrolidinesulfonic acid, 1-hydroxy-2,5-dioxo-, monosodium salt,sodium 1-hydroxy-2,5-dioxo-pyrrolidine-3-sulfonate,n-hydroxusulfosuccinimide sodium,n-hydroxy-2-sodiosulfo succinimide,n-hydroxysulfosuccinimide,sodium salt,n-hydroxusulfosuccinimide sodium salt |
| IUPAC Name | sodium;1-hydroxy-2,5-dioxopyrrolidine-3-sulfonate |
| InChI Key | RPENMORRBUTCPR-UHFFFAOYSA-M |
| Molecular Formula | C4H4NNaO6S |
Iron(III) meso-tetraphenylporphine-mu-oxo dimer
CAS: 12582-61-5 Molecular Formula: C88H58Fe2N8O Molecular Weight (g/mol): 1355.177 MDL Number: MFCD00058898 InChI Key: JTFKJCUSDKAMIA-UHFFFAOYSA-N Synonym: iron iii meso-tetraphenylporphine-mu-oxo dimer,iron,m-oxobis 5,10,15,20-tetraphenyl-21h,23h-porphinato 2--kn21,kn22,kn23,kn24 di PubChem CID: 11981848 IUPAC Name: iron(2+);5,10,15,20-tetraphenylporphyrin-22,24-diide;hydrate SMILES: C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.O.[Fe+2].[Fe+2]
| PubChem CID | 11981848 |
|---|---|
| CAS | 12582-61-5 |
| Molecular Weight (g/mol) | 1355.177 |
| MDL Number | MFCD00058898 |
| SMILES | C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)C=C4)C9=CC=CC=C9)[N-]3.O.[Fe+2].[Fe+2] |
| Synonym | iron iii meso-tetraphenylporphine-mu-oxo dimer,iron,m-oxobis 5,10,15,20-tetraphenyl-21h,23h-porphinato 2--kn21,kn22,kn23,kn24 di |
| IUPAC Name | iron(2+);5,10,15,20-tetraphenylporphyrin-22,24-diide;hydrate |
| InChI Key | JTFKJCUSDKAMIA-UHFFFAOYSA-N |
| Molecular Formula | C88H58Fe2N8O |
Ethyl 3,5-dimethylisoxazole-4-carboxylate, 97%
CAS: 17147-42-1 Molecular Formula: C8H11NO3 Molecular Weight (g/mol): 169.18 MDL Number: MFCD00052557 InChI Key: OQRHVDXUJAQVNT-UHFFFAOYSA-N Synonym: ethyl 3,5-dimethylisoxazole-4-carboxylate,ethyl 3,5-dimethyl-4-isoxazolecarboxylate,3,5-dimethylisoxazole-4-carboxylic acid ethyl ester,4-isoxazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3,5-dimethyl-4-ethoxycarbonyl isoxazole,ethyl 3,5-dimethyl-isoxazole-4-carboxylate,acmc-1c48c,ethyldimethylisoxazolecarboxylate,4-carbethoxy-3,5-dimethylisoxazole,4-carboethoxy-3,5-dimethylisoxazole PubChem CID: 736348 IUPAC Name: ethyl 3,5-dimethyl-1,2-oxazole-4-carboxylate SMILES: CCOC(=O)C1=C(ON=C1C)C
| PubChem CID | 736348 |
|---|---|
| CAS | 17147-42-1 |
| Molecular Weight (g/mol) | 169.18 |
| MDL Number | MFCD00052557 |
| SMILES | CCOC(=O)C1=C(ON=C1C)C |
| Synonym | ethyl 3,5-dimethylisoxazole-4-carboxylate,ethyl 3,5-dimethyl-4-isoxazolecarboxylate,3,5-dimethylisoxazole-4-carboxylic acid ethyl ester,4-isoxazolecarboxylic acid, 3,5-dimethyl-, ethyl ester,3,5-dimethyl-4-ethoxycarbonyl isoxazole,ethyl 3,5-dimethyl-isoxazole-4-carboxylate,acmc-1c48c,ethyldimethylisoxazolecarboxylate,4-carbethoxy-3,5-dimethylisoxazole,4-carboethoxy-3,5-dimethylisoxazole |
| IUPAC Name | ethyl 3,5-dimethyl-1,2-oxazole-4-carboxylate |
| InChI Key | OQRHVDXUJAQVNT-UHFFFAOYSA-N |
| Molecular Formula | C8H11NO3 |
2-Oxa-7-azaspiro[3.5]nonane hemioxalate, 97%
CAS: 1429056-28-9 Molecular Formula: C16H28N2O6 Molecular Weight (g/mol): 344.408 MDL Number: MFCD11035888 InChI Key: WWVUFRRXXSVWBJ-UHFFFAOYSA-N Synonym: 2-oxa-7-azaspiro 3.5 nonane oxalate 2:1,2-oxa-7-azaspiro 3.5 nonane hemioxalate,bis 2-oxa-7-azaspiro 3.5 nonane ; oxalic acid,2-oxa-7-azaspiro 3.5 nonan hemioxalate,2-oxa-7-azaspiro 3,5 nonane hemioxalate,bis 2-oxa-7-azaspiro 3.5 nonane oxalate,2-oxa-7-azaspiro 3.5 nonane hemi-oxalate PubChem CID: 71463619 IUPAC Name: 2-oxa-7-azaspiro[3.5]nonane;oxalic acid SMILES: C1CNCCC12COC2.C1CNCCC12COC2.C(=O)(C(=O)O)O
| PubChem CID | 71463619 |
|---|---|
| CAS | 1429056-28-9 |
| Molecular Weight (g/mol) | 344.408 |
| MDL Number | MFCD11035888 |
| SMILES | C1CNCCC12COC2.C1CNCCC12COC2.C(=O)(C(=O)O)O |
| Synonym | 2-oxa-7-azaspiro 3.5 nonane oxalate 2:1,2-oxa-7-azaspiro 3.5 nonane hemioxalate,bis 2-oxa-7-azaspiro 3.5 nonane ; oxalic acid,2-oxa-7-azaspiro 3.5 nonan hemioxalate,2-oxa-7-azaspiro 3,5 nonane hemioxalate,bis 2-oxa-7-azaspiro 3.5 nonane oxalate,2-oxa-7-azaspiro 3.5 nonane hemi-oxalate |
| IUPAC Name | 2-oxa-7-azaspiro[3.5]nonane;oxalic acid |
| InChI Key | WWVUFRRXXSVWBJ-UHFFFAOYSA-N |
| Molecular Formula | C16H28N2O6 |
3-Bromo-2-fluoro-5-nitropyridine, 97%
CAS: 1868-58-2 Molecular Formula: C5H2BrFN2O2 Molecular Weight (g/mol): 220.99 MDL Number: MFCD08703668 InChI Key: NLLPMLSUMJHTCJ-UHFFFAOYSA-N Synonym: 2-fluoro-3-bromo-5-nitropyridine,acmc-1celf,3-bromanyl-2-fluoranyl-5-nitro-pyridine PubChem CID: 345124 IUPAC Name: 3-bromo-2-fluoro-5-nitropyridine SMILES: [O-][N+](=O)C1=CN=C(F)C(Br)=C1
| PubChem CID | 345124 |
|---|---|
| CAS | 1868-58-2 |
| Molecular Weight (g/mol) | 220.99 |
| MDL Number | MFCD08703668 |
| SMILES | [O-][N+](=O)C1=CN=C(F)C(Br)=C1 |
| Synonym | 2-fluoro-3-bromo-5-nitropyridine,acmc-1celf,3-bromanyl-2-fluoranyl-5-nitro-pyridine |
| IUPAC Name | 3-bromo-2-fluoro-5-nitropyridine |
| InChI Key | NLLPMLSUMJHTCJ-UHFFFAOYSA-N |
| Molecular Formula | C5H2BrFN2O2 |
2-Hydroxy-6-methylnicotinic acid, 98+%
CAS: 38116-61-9 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.137 MDL Number: MFCD00006272 InChI Key: XRIHTJYXIHOBDQ-UHFFFAOYSA-N Synonym: 2-hydroxy-6-methylnicotinic acid,2-hydroxy-6-methylpyridine-3-carboxylic acid,6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid,chembl50725,3-pyridinecarboxylic acid, 1,2-dihydro-6-methyl-2-oxo,2-hydroxy-6-methyl nicotinic acid,2-hydroxy-6-methyl-nicotinic acid,6-methyl-2-oxo-1,2-dihydro-pyridine-3-carboxylic acid,6-methyl-2-oxohydropyridine-3-carboxylic acid,2-hydroxy-6-methylnicotinicacid PubChem CID: 94960 IUPAC Name: 6-methyl-2-oxo-1H-pyridine-3-carboxylic acid SMILES: CC1=CC=C(C(=O)N1)C(=O)O
| PubChem CID | 94960 |
|---|---|
| CAS | 38116-61-9 |
| Molecular Weight (g/mol) | 153.137 |
| MDL Number | MFCD00006272 |
| SMILES | CC1=CC=C(C(=O)N1)C(=O)O |
| Synonym | 2-hydroxy-6-methylnicotinic acid,2-hydroxy-6-methylpyridine-3-carboxylic acid,6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid,chembl50725,3-pyridinecarboxylic acid, 1,2-dihydro-6-methyl-2-oxo,2-hydroxy-6-methyl nicotinic acid,2-hydroxy-6-methyl-nicotinic acid,6-methyl-2-oxo-1,2-dihydro-pyridine-3-carboxylic acid,6-methyl-2-oxohydropyridine-3-carboxylic acid,2-hydroxy-6-methylnicotinicacid |
| IUPAC Name | 6-methyl-2-oxo-1H-pyridine-3-carboxylic acid |
| InChI Key | XRIHTJYXIHOBDQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO3 |
Pyrido[2,3-b]pyrazine, 98%
CAS: 322-46-3 Molecular Formula: C7H5N3 Molecular Weight (g/mol): 131.14 MDL Number: MFCD00006717 InChI Key: YEYHFKBVNARCNE-UHFFFAOYSA-N Synonym: pyrido 2,3-b pyrazine,1,4,5-triazanaphthalene,5-azaquinoxaline,pyrido 2,3 pyrazine,pyrido 3,2-b pyrazine,acmc-20ahgw,1,5-triazanaphthalene,pyridino 2,3-b pyrazine PubChem CID: 67580 IUPAC Name: pyrido[2,3-b]pyrazine SMILES: C1=CN=C2N=CC=NC2=C1
| PubChem CID | 67580 |
|---|---|
| CAS | 322-46-3 |
| Molecular Weight (g/mol) | 131.14 |
| MDL Number | MFCD00006717 |
| SMILES | C1=CN=C2N=CC=NC2=C1 |
| Synonym | pyrido 2,3-b pyrazine,1,4,5-triazanaphthalene,5-azaquinoxaline,pyrido 2,3 pyrazine,pyrido 3,2-b pyrazine,acmc-20ahgw,1,5-triazanaphthalene,pyridino 2,3-b pyrazine |
| IUPAC Name | pyrido[2,3-b]pyrazine |
| InChI Key | YEYHFKBVNARCNE-UHFFFAOYSA-N |
| Molecular Formula | C7H5N3 |