Organoheterocyclic compounds
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4-(chloromethyl)-2-phenyl-1,3-thiazole, 97%, Thermo Scientific™
CAS: 4771-31-7 Molecular Formula: C10H8ClNS Molecular Weight (g/mol): 209.691 MDL Number: MFCD00723503 InChI Key: SVEGSFSFMLCNFF-UHFFFAOYSA-N Synonym: 4-chloromethyl-2-phenyl-1,3-thiazole,4-chloromethyl-2-phenylthiazole,thiazole, 4-chloromethyl-2-phenyl,2-phenyl-4-chloromethylthiazole,4-chloromethyl-2-phenyl-thiazole,2-phenyl-4-chloromethyl thiazole,enamine_002044,2-phenyl-4-chloromethyl-thiazole,2-phenyl-1,3-thiazol-4-ylmethyl chloride PubChem CID: 236969 IUPAC Name: 4-(chloromethyl)-2-phenyl-1,3-thiazole SMILES: C1=CC=C(C=C1)C2=NC(=CS2)CCl
| PubChem CID | 236969 |
|---|---|
| CAS | 4771-31-7 |
| Molecular Weight (g/mol) | 209.691 |
| MDL Number | MFCD00723503 |
| SMILES | C1=CC=C(C=C1)C2=NC(=CS2)CCl |
| Synonym | 4-chloromethyl-2-phenyl-1,3-thiazole,4-chloromethyl-2-phenylthiazole,thiazole, 4-chloromethyl-2-phenyl,2-phenyl-4-chloromethylthiazole,4-chloromethyl-2-phenyl-thiazole,2-phenyl-4-chloromethyl thiazole,enamine_002044,2-phenyl-4-chloromethyl-thiazole,2-phenyl-1,3-thiazol-4-ylmethyl chloride |
| IUPAC Name | 4-(chloromethyl)-2-phenyl-1,3-thiazole |
| InChI Key | SVEGSFSFMLCNFF-UHFFFAOYSA-N |
| Molecular Formula | C10H8ClNS |
4-Methyl-2-phenyl-1,3-thiazole-5-carboxylic acid, 95%, Thermo Scientific™
CAS: 33763-20-1 Molecular Formula: C11H8NO2S Molecular Weight (g/mol): 218.25 MDL Number: MFCD00141955 InChI Key: CRSMRBYEBHOYRM-UHFFFAOYSA-M Synonym: 4-methyl-2-phenylthiazole-5-carboxylic acid,5-thiazolecarboxylic acid, 4-methyl-2-phenyl,4-methyl-2-phenyl-thiazole-5-carboxylic acid,4-methyl-2-phenyl-5-thiazolecarboxylic acid,2-phenyl-4-methylthiazole-5-carboxylic acid,maybridge1_008941,5-thiazolecarboxylicacid, 4-methyl-2-phenyl,4-methyl-2-phenyl-1,3-thiazol-5-carboxylic acid PubChem CID: 720957 IUPAC Name: 4-methyl-2-phenyl-1,3-thiazole-5-carboxylic acid SMILES: CC1=C(SC(=N1)C1=CC=CC=C1)C([O-])=O
| PubChem CID | 720957 |
|---|---|
| CAS | 33763-20-1 |
| Molecular Weight (g/mol) | 218.25 |
| MDL Number | MFCD00141955 |
| SMILES | CC1=C(SC(=N1)C1=CC=CC=C1)C([O-])=O |
| Synonym | 4-methyl-2-phenylthiazole-5-carboxylic acid,5-thiazolecarboxylic acid, 4-methyl-2-phenyl,4-methyl-2-phenyl-thiazole-5-carboxylic acid,4-methyl-2-phenyl-5-thiazolecarboxylic acid,2-phenyl-4-methylthiazole-5-carboxylic acid,maybridge1_008941,5-thiazolecarboxylicacid, 4-methyl-2-phenyl,4-methyl-2-phenyl-1,3-thiazol-5-carboxylic acid |
| IUPAC Name | 4-methyl-2-phenyl-1,3-thiazole-5-carboxylic acid |
| InChI Key | CRSMRBYEBHOYRM-UHFFFAOYSA-M |
| Molecular Formula | C11H8NO2S |
Ethyl picolinate, 99%
CAS: 2524-52-9 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00006292 InChI Key: FQYYIPZPELSLDK-UHFFFAOYSA-N Synonym: ethyl picolinate,ethyl 2-picolinate,ethyl 2-pyridinecarboxylate,picolinic acid, ethyl ester,2-picolinic acid ethyl ester,2-pyridinecarboxylic acid, ethyl ester,2-ethoxycarbonyl pyridine,picolinic acid ethyl ester,2-pyridinecarboxylic acid ethyl ester,pyridine-2-carboxylic acid ethyl ester PubChem CID: 17307 IUPAC Name: ethyl pyridine-2-carboxylate SMILES: CCOC(=O)C1=CC=CC=N1
| PubChem CID | 17307 |
|---|---|
| CAS | 2524-52-9 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00006292 |
| SMILES | CCOC(=O)C1=CC=CC=N1 |
| Synonym | ethyl picolinate,ethyl 2-picolinate,ethyl 2-pyridinecarboxylate,picolinic acid, ethyl ester,2-picolinic acid ethyl ester,2-pyridinecarboxylic acid, ethyl ester,2-ethoxycarbonyl pyridine,picolinic acid ethyl ester,2-pyridinecarboxylic acid ethyl ester,pyridine-2-carboxylic acid ethyl ester |
| IUPAC Name | ethyl pyridine-2-carboxylate |
| InChI Key | FQYYIPZPELSLDK-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
5-(4-Pyridyl)-1H-tetrazole, 98%, Thermo Scientific Chemicals
CAS: 14389-12-9 Molecular Formula: C6H5N5 Molecular Weight (g/mol): 147.141 MDL Number: MFCD00068115 InChI Key: JMILUUVWLRKJFB-UHFFFAOYSA-N Synonym: 5-4-pyridyl-1h-tetrazole,4-2h-tetrazol-5-yl pyridine,4-1h-tetrazol-5-yl pyridine,4-2h-tetrazol-5-yl-pyridine,4-1h-1,2,3,4-tetrazol-5-yl pyridine,4-2h-1,2,3,4-tetrazol-5-yl pyridine,pyridine, 4-2h-tetrazol-5-yl,5-4-pyridyl-1 h-tetrazole,5-4-pyridyl-2h-1,2,3,4-tetraazole,acmc-20amxi PubChem CID: 482249 IUPAC Name: 4-(2H-tetrazol-5-yl)pyridine SMILES: C1=CN=CC=C1C2=NNN=N2
| PubChem CID | 482249 |
|---|---|
| CAS | 14389-12-9 |
| Molecular Weight (g/mol) | 147.141 |
| MDL Number | MFCD00068115 |
| SMILES | C1=CN=CC=C1C2=NNN=N2 |
| Synonym | 5-4-pyridyl-1h-tetrazole,4-2h-tetrazol-5-yl pyridine,4-1h-tetrazol-5-yl pyridine,4-2h-tetrazol-5-yl-pyridine,4-1h-1,2,3,4-tetrazol-5-yl pyridine,4-2h-1,2,3,4-tetrazol-5-yl pyridine,pyridine, 4-2h-tetrazol-5-yl,5-4-pyridyl-1 h-tetrazole,5-4-pyridyl-2h-1,2,3,4-tetraazole,acmc-20amxi |
| IUPAC Name | 4-(2H-tetrazol-5-yl)pyridine |
| InChI Key | JMILUUVWLRKJFB-UHFFFAOYSA-N |
| Molecular Formula | C6H5N5 |
3-Thiopheneacetic acid, 98%
CAS: 6964-21-2 Molecular Formula: C6H6O2S Molecular Weight (g/mol): 142.172 MDL Number: MFCD00005473 InChI Key: RCNOGGGBSSVMAS-UHFFFAOYSA-N Synonym: 3-thiopheneacetic acid,3-thienylacetic acid,2-thiophen-3-yl acetic acid,thiophene-3-acetic acid,thiophen-3-yl-acetic acid,3-thiophenacetic acid,thien-3-ylacetic acid,3-thiopheneethanoic acid,thiophen-3-ylacetic acid,2-3-thienyl acetic acid PubChem CID: 23404 IUPAC Name: 2-thiophen-3-ylacetic acid SMILES: C1=CSC=C1CC(=O)O
| PubChem CID | 23404 |
|---|---|
| CAS | 6964-21-2 |
| Molecular Weight (g/mol) | 142.172 |
| MDL Number | MFCD00005473 |
| SMILES | C1=CSC=C1CC(=O)O |
| Synonym | 3-thiopheneacetic acid,3-thienylacetic acid,2-thiophen-3-yl acetic acid,thiophene-3-acetic acid,thiophen-3-yl-acetic acid,3-thiophenacetic acid,thien-3-ylacetic acid,3-thiopheneethanoic acid,thiophen-3-ylacetic acid,2-3-thienyl acetic acid |
| IUPAC Name | 2-thiophen-3-ylacetic acid |
| InChI Key | RCNOGGGBSSVMAS-UHFFFAOYSA-N |
| Molecular Formula | C6H6O2S |
5-Amino-1H-tetrazole monohydrate, 99%
CAS: 15454-54-3 Molecular Formula: CH5N5O Molecular Weight (g/mol): 103.085 MDL Number: MFCD00149327 InChI Key: JVSMPWHQUPKRNV-UHFFFAOYSA-N Synonym: 1h-tetrazol-5-amine hydrate,5-amino-1h-tetrazole monohydrate,5-aminotetrazole monohydrate,5-amino-1h-tetrazole hydrate,5-aminotetrazole hydrate,1h-1,2,3,4-tetrazol-5-amine hydrate,2h-1,2,3,4-tetrazol-5-amine hydrate,tetrazol-5-amine,5-aminotetrazole.h2o,5-aminotetrazole h2o PubChem CID: 12211273 IUPAC Name: 2H-tetrazol-5-amine;hydrate SMILES: C1(=NNN=N1)N.O
| PubChem CID | 12211273 |
|---|---|
| CAS | 15454-54-3 |
| Molecular Weight (g/mol) | 103.085 |
| MDL Number | MFCD00149327 |
| SMILES | C1(=NNN=N1)N.O |
| Synonym | 1h-tetrazol-5-amine hydrate,5-amino-1h-tetrazole monohydrate,5-aminotetrazole monohydrate,5-amino-1h-tetrazole hydrate,5-aminotetrazole hydrate,1h-1,2,3,4-tetrazol-5-amine hydrate,2h-1,2,3,4-tetrazol-5-amine hydrate,tetrazol-5-amine,5-aminotetrazole.h2o,5-aminotetrazole h2o |
| IUPAC Name | 2H-tetrazol-5-amine;hydrate |
| InChI Key | JVSMPWHQUPKRNV-UHFFFAOYSA-N |
| Molecular Formula | CH5N5O |
2-Methylbenzimidazole, 98%
CAS: 615-15-6 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.17 MDL Number: MFCD00005598 InChI Key: LDZYRENCLPUXAX-UHFFFAOYSA-N Synonym: 2-methylbenzimidazole,2-methyl-1h-benzo d imidazole,1h-benzimidazole, 2-methyl,benzimidazole, 2-methyl,2-methyl-1h-benzoimidazole,2-methyl-1h-1,3-benzodiazole,acetamidine, n-n'-o-phenylene,2-methyl benzimidazole,unii-zh8iww7y8b,2-methylbenaimidazole PubChem CID: 11984 IUPAC Name: 2-methyl-1H-benzimidazole SMILES: CC1=NC2=CC=CC=C2N1
| PubChem CID | 11984 |
|---|---|
| CAS | 615-15-6 |
| Molecular Weight (g/mol) | 132.17 |
| MDL Number | MFCD00005598 |
| SMILES | CC1=NC2=CC=CC=C2N1 |
| Synonym | 2-methylbenzimidazole,2-methyl-1h-benzo d imidazole,1h-benzimidazole, 2-methyl,benzimidazole, 2-methyl,2-methyl-1h-benzoimidazole,2-methyl-1h-1,3-benzodiazole,acetamidine, n-n'-o-phenylene,2-methyl benzimidazole,unii-zh8iww7y8b,2-methylbenaimidazole |
| IUPAC Name | 2-methyl-1H-benzimidazole |
| InChI Key | LDZYRENCLPUXAX-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2 |
Pyrrole-2-carbonitrile, 99%
CAS: 4513-94-4 Molecular Formula: C5H4N2 Molecular Weight (g/mol): 92.10 MDL Number: MFCD00234061 InChI Key: BQMPGKPTOHKYHS-UHFFFAOYSA-N Synonym: pyrrole-2-carbonitrile,2-cyanopyrrole,unii-6d25bmc1pp,2-carbonitrilepyrrole,6d25bmc1pp,cyanopyrrole,2-cyano-pyrrol,pyrrole carbonitrile,1h-pyrrolecarbonitrile,1h-pyrrol-2-kohlenitrile PubChem CID: 138277 IUPAC Name: 1H-pyrrole-2-carbonitrile SMILES: N#CC1=CC=CN1
| PubChem CID | 138277 |
|---|---|
| CAS | 4513-94-4 |
| Molecular Weight (g/mol) | 92.10 |
| MDL Number | MFCD00234061 |
| SMILES | N#CC1=CC=CN1 |
| Synonym | pyrrole-2-carbonitrile,2-cyanopyrrole,unii-6d25bmc1pp,2-carbonitrilepyrrole,6d25bmc1pp,cyanopyrrole,2-cyano-pyrrol,pyrrole carbonitrile,1h-pyrrolecarbonitrile,1h-pyrrol-2-kohlenitrile |
| IUPAC Name | 1H-pyrrole-2-carbonitrile |
| InChI Key | BQMPGKPTOHKYHS-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2 |
5-Phenyl-1H-tetrazole, 99%
CAS: 18039-42-4 Molecular Formula: C7H6N4 Molecular Weight (g/mol): 146.153 MDL Number: MFCD00022388 InChI Key: MARUHZGHZWCEQU-UHFFFAOYSA-N Synonym: 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van PubChem CID: 87425 IUPAC Name: 5-phenyl-2H-tetrazole SMILES: C1=CC=C(C=C1)C2=NNN=N2
| PubChem CID | 87425 |
|---|---|
| CAS | 18039-42-4 |
| Molecular Weight (g/mol) | 146.153 |
| MDL Number | MFCD00022388 |
| SMILES | C1=CC=C(C=C1)C2=NNN=N2 |
| Synonym | 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van |
| IUPAC Name | 5-phenyl-2H-tetrazole |
| InChI Key | MARUHZGHZWCEQU-UHFFFAOYSA-N |
| Molecular Formula | C7H6N4 |
Furfuryl mercaptan, 97%
CAS: 98-02-2 Molecular Formula: C5H6OS Molecular Weight (g/mol): 114.16 MDL Number: MFCD00003254 InChI Key: ZFFTZDQKIXPDAF-UHFFFAOYSA-N Synonym: furfuryl mercaptan,2-furanmethanethiol,2-furylmethanethiol,furfuryl thiol,2-furylmethyl mercaptan,2-furfurylmercaptan,furan-2-yl-methanethiol,2-mercaptomethyl furan,furfurylmercaptan,2-furfurylthiol PubChem CID: 7363 IUPAC Name: furan-2-ylmethanethiol SMILES: C1=COC(=C1)CS
| PubChem CID | 7363 |
|---|---|
| CAS | 98-02-2 |
| Molecular Weight (g/mol) | 114.16 |
| MDL Number | MFCD00003254 |
| SMILES | C1=COC(=C1)CS |
| Synonym | furfuryl mercaptan,2-furanmethanethiol,2-furylmethanethiol,furfuryl thiol,2-furylmethyl mercaptan,2-furfurylmercaptan,furan-2-yl-methanethiol,2-mercaptomethyl furan,furfurylmercaptan,2-furfurylthiol |
| IUPAC Name | furan-2-ylmethanethiol |
| InChI Key | ZFFTZDQKIXPDAF-UHFFFAOYSA-N |
| Molecular Formula | C5H6OS |
5-Aminobenzothiazole, 95%
CAS: 1123-93-9 Molecular Formula: C7H6N2S Molecular Weight (g/mol): 150.20 MDL Number: MFCD04115282 InChI Key: UJZYHMZRXGNDFB-UHFFFAOYSA-N Synonym: 5-benzothiazolamine,benzothiazol-5-ylamine,benzo d thiazol-5-amine,benzothiazol-5-amine,5-amino-1,3-benzothiazole,5-aminobenzothiazole,1,3-benzothiazole-5-amine,1,3-benzothiazol-5-ylamine,5-amino-1,3-benzothiazol,5-amino-benzothiazole PubChem CID: 70749 IUPAC Name: 1,3-benzothiazol-5-amine SMILES: NC1=CC=C2SC=NC2=C1
| PubChem CID | 70749 |
|---|---|
| CAS | 1123-93-9 |
| Molecular Weight (g/mol) | 150.20 |
| MDL Number | MFCD04115282 |
| SMILES | NC1=CC=C2SC=NC2=C1 |
| Synonym | 5-benzothiazolamine,benzothiazol-5-ylamine,benzo d thiazol-5-amine,benzothiazol-5-amine,5-amino-1,3-benzothiazole,5-aminobenzothiazole,1,3-benzothiazole-5-amine,1,3-benzothiazol-5-ylamine,5-amino-1,3-benzothiazol,5-amino-benzothiazole |
| IUPAC Name | 1,3-benzothiazol-5-amine |
| InChI Key | UJZYHMZRXGNDFB-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2S |
2,6-Dimethylpyrazine, 99%
CAS: 108-50-9 Molecular Formula: C6H8N2 Molecular Weight (g/mol): 108.144 MDL Number: MFCD00006148 InChI Key: HJFZAYHYIWGLNL-UHFFFAOYSA-N Synonym: pyrazine, 2,6-dimethyl,3,5-dimethylpyrazine,2,6-dimethylpiazine,2,6-dimethylparadiazine,2,6-dimethyl-1,4-diazine,ccris 2930,unii-n77q72c9i3,fema no. 3273,natural,2,6-dimethyl pyrazine PubChem CID: 7938 IUPAC Name: 2,6-dimethylpyrazine SMILES: CC1=CN=CC(=N1)C
| PubChem CID | 7938 |
|---|---|
| CAS | 108-50-9 |
| Molecular Weight (g/mol) | 108.144 |
| MDL Number | MFCD00006148 |
| SMILES | CC1=CN=CC(=N1)C |
| Synonym | pyrazine, 2,6-dimethyl,3,5-dimethylpyrazine,2,6-dimethylpiazine,2,6-dimethylparadiazine,2,6-dimethyl-1,4-diazine,ccris 2930,unii-n77q72c9i3,fema no. 3273,natural,2,6-dimethyl pyrazine |
| IUPAC Name | 2,6-dimethylpyrazine |
| InChI Key | HJFZAYHYIWGLNL-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2 |
Pyridazine, 98+%
CAS: 289-80-5 Molecular Formula: C4H4N2 Molecular Weight (g/mol): 80.09 MDL Number: MFCD00006463 InChI Key: PBMFSQRYOILNGV-UHFFFAOYSA-N Synonym: orthodiazine,1,2-diazine,o-diazine,1,2-diazabenzene,pyridazin,1,2-diazin,oizine,pyridazine,pubchem17789,acmc-209h5x PubChem CID: 9259 ChEBI: CHEBI:30954 IUPAC Name: pyridazine SMILES: C1=CC=NN=C1
| PubChem CID | 9259 |
|---|---|
| CAS | 289-80-5 |
| Molecular Weight (g/mol) | 80.09 |
| ChEBI | CHEBI:30954 |
| MDL Number | MFCD00006463 |
| SMILES | C1=CC=NN=C1 |
| Synonym | orthodiazine,1,2-diazine,o-diazine,1,2-diazabenzene,pyridazin,1,2-diazin,oizine,pyridazine,pubchem17789,acmc-209h5x |
| IUPAC Name | pyridazine |
| InChI Key | PBMFSQRYOILNGV-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2 |
3-Methylthiophene, 98+%
CAS: 616-44-4 Molecular Formula: C5H6S Molecular Weight (g/mol): 98.163 MDL Number: MFCD00005470 InChI Key: QENGPZGAWFQWCZ-UHFFFAOYSA-N Synonym: thiophene, 3-methyl,3-thiotolene,beta-methylthiophene,poly,p3mt,3-methyl thiophene,3-methyl-thiophene,methyl-3-thiophene,ccris 2937,thiophene, 3-methyl-, homopolymer PubChem CID: 12024 IUPAC Name: 3-methylthiophene SMILES: CC1=CSC=C1
| PubChem CID | 12024 |
|---|---|
| CAS | 616-44-4 |
| Molecular Weight (g/mol) | 98.163 |
| MDL Number | MFCD00005470 |
| SMILES | CC1=CSC=C1 |
| Synonym | thiophene, 3-methyl,3-thiotolene,beta-methylthiophene,poly,p3mt,3-methyl thiophene,3-methyl-thiophene,methyl-3-thiophene,ccris 2937,thiophene, 3-methyl-, homopolymer |
| IUPAC Name | 3-methylthiophene |
| InChI Key | QENGPZGAWFQWCZ-UHFFFAOYSA-N |
| Molecular Formula | C5H6S |
2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile, 97%
CAS: 4651-91-6 Molecular Formula: C9H10N2S Molecular Weight (g/mol): 178.253 MDL Number: MFCD00128278 InChI Key: ADHVMGAFAKSNOM-UHFFFAOYSA-N Synonym: 2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitrile,2-amino-3-cyano-4,5,6,7-tetrahydrobenzo b thiophene,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3-carbonitrile,benzo b thiophene-3-carbonitrile, 2-amino-4,5,6,7-tetrahydro,2-amino-4,5,6,7-tetrahydro-1-benzo b thiophene-3-carbonitrile,2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitryle,cambridge id 5130181,aminotetrahydrobenzothiophenecarbonitrile PubChem CID: 78382 IUPAC Name: 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile SMILES: C1CCC2=C(C1)C(=C(S2)N)C#N
| PubChem CID | 78382 |
|---|---|
| CAS | 4651-91-6 |
| Molecular Weight (g/mol) | 178.253 |
| MDL Number | MFCD00128278 |
| SMILES | C1CCC2=C(C1)C(=C(S2)N)C#N |
| Synonym | 2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitrile,2-amino-3-cyano-4,5,6,7-tetrahydrobenzo b thiophene,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3-carbonitrile,benzo b thiophene-3-carbonitrile, 2-amino-4,5,6,7-tetrahydro,2-amino-4,5,6,7-tetrahydro-1-benzo b thiophene-3-carbonitrile,2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitryle,cambridge id 5130181,aminotetrahydrobenzothiophenecarbonitrile |
| IUPAC Name | 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| InChI Key | ADHVMGAFAKSNOM-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2S |