methyl 5-azanyl-4-(phenylmethylsulfanyl)thiophene-3-carboxylate

Systemtic Name: methyl 5-azanyl-4-(phenylmethylsulfanyl)thiophene-3-carboxylate Openeye Name: methyl 5-amino-4-benzylsulfanyl-thiophene-3-carboxylate CAS Name: 5-amino-4-(phenylmethylthio)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-4-benzylsulfanylthiophene-3-carboxylate Traditional Name: 5-amino-4-(benzylthio)thiophene-3-carboxylic acid methyl ester Formula: C13H13NO2S2 MolecularWeight: 279.37782

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC(=C1SCC2=CC=CC=C2)N

Isomeric SMILES

COC(=O)C1=CSC(=C1SCC2=CC=CC=C2)N

InChI

InChI=1S/C13H13NO2S2/c1-16-13(15)10-8-18-12(14)11(10)17-7-9-5-3-2-4-6-9/h2-6,8H,7,14H2,1H3