methyl 5-[(4-methylsulfanylphenyl)methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-[(4-methylsulfanylphenyl)methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: methyl 2-anilino-5-[(4-methylsulfanylphenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: 2-anilino-5-[[4-(methylthio)phenyl]methylidene]-4-oxo-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-anilino-5-[(4-methylsulfanylphenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: 2-anilino-4-keto-5-[4-(methylthio)benzylidene]thiophene-3-carboxylic acid methyl ester Formula: C20H17NO3S2 MolecularWeight: 383.48388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=CC2=CC=C(C=C2)SC)C1=O)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC(=CC2=CC=C(C=C2)SC)C1=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H17NO3S2/c1-24-20(23)17-18(22)16(12-13-8-10-15(25-2)11-9-13)26-19(17)21-14-6-4-3-5-7-14/h3-12,21H,1-2H3