methyl 4-azanyl-5-(2,2-dicyano-1-phenyl-ethenyl)-2-methylsulfanyl-thiophene-3-carboxylate

Systemtic Name: methyl 4-azanyl-5-(2,2-dicyano-1-phenyl-ethenyl)-2-methylsulfanyl-thiophene-3-carboxylate Openeye Name: methyl 4-amino-5-(2,2-dicyano-1-phenyl-vinyl)-2-methylsulfanyl-thiophene-3-carboxylate CAS Name: 4-amino-5-(2,2-dicyano-1-phenylethenyl)-2-(methylthio)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-5-(2,2-dicyano-1-phenylethenyl)-2-methylsulfanylthiophene-3-carboxylate Traditional Name: 4-amino-5-(2,2-dicyano-1-phenyl-vinyl)-2-(methylthio)thiophene-3-carboxylic acid methyl ester Formula: C17H13N3O2S2 MolecularWeight: 355.43402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1N)C(=C(C#N)C#N)C2=CC=CC=C2)SC

Isomeric SMILES

COC(=O)C1=C(SC(=C1N)C(=C(C#N)C#N)C2=CC=CC=C2)SC

InChI

InChI=1S/C17H13N3O2S2/c1-22-16(21)13-14(20)15(24-17(13)23-2)12(11(8-18)9-19)10-6-4-3-5-7-10/h3-7H,20H2,1-2H3