ethyl 2-[(4-chlorophenyl)amino]-5-[(4-methylsulfanylphenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-chlorophenyl)amino]-5-[(4-methylsulfanylphenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl 2-(4-chloroanilino)-5-[(4-methylsulfanylphenyl)methylene]-4-oxo-thiophene-3-carboxylate CAS Name: 2-(4-chloroanilino)-5-[[4-(methylthio)phenyl]methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chloroanilino)-5-[(4-methylsulfanylphenyl)methylidene]-4-oxothiophene-3-carboxylate Traditional Name: 2-(4-chloroanilino)-4-keto-5-[4-(methylthio)benzylidene]thiophene-3-carboxylic acid ethyl ester Formula: C21H18ClNO3S2 MolecularWeight: 431.95552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClNO3S2/c1-3-26-21(25)18-19(24)17(12-13-4-10-16(27-2)11-5-13)28-20(18)23-15-8-6-14(22)7-9-15/h4-12,23H,3H2,1-2H3