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

Systemtic Name: ethyl (5E)-2-[(4-chlorophenyl)amino]-4-oxidanylidene-5-[(4-phenylmethoxyphenyl)methylidene]thiophene-3-carboxylate Openeye Name: ethyl (5E)-5-[(4-benzyloxyphenyl)methylene]-2-(4-chloroanilino)-4-oxo-thiophene-3-carboxylate CAS Name: (5E)-2-(4-chloroanilino)-4-oxo-5-[(4-phenylmethoxyphenyl)methylidene]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-2-(4-chloroanilino)-4-oxo-5-[(4-phenylmethoxyphenyl)methylidene]thiophene-3-carboxylate Traditional Name: (5E)-5-(4-benzoxybenzylidene)-2-(4-chloroanilino)-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C27H22ClNO4S MolecularWeight: 491.98588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)OCC3=CC=CC=C3)C1=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C/C2=CC=C(C=C2)OCC3=CC=CC=C3)/C1=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H22ClNO4S/c1-2-32-27(31)24-25(30)23(34-26(24)29-21-12-10-20(28)11-13-21)16-18-8-14-22(15-9-18)33-17-19-6-4-3-5-7-19/h3-16,29H,2,17H2,1H3/b23-16+