ethyl (5Z)-5-[[3-chloranyl-4-(cyanomethoxy)phenyl]methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate

Systemtic Name: ethyl (5Z)-5-[[3-chloranyl-4-(cyanomethoxy)phenyl]methylidene]-4-oxidanylidene-2-phenylazanyl-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-2-anilino-5-[[3-chloro-4-(cyanomethoxy)phenyl]methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-anilino-5-[[3-chloro-4-(cyanomethoxy)phenyl]methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-anilino-5-[[3-chloro-4-(cyanomethoxy)phenyl]methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-2-anilino-5-[3-chloro-4-(cyanomethoxy)benzylidene]-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C22H17ClN2O4S MolecularWeight: 440.89938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C\C2=CC(=C(C=C2)OCC#N)Cl)/C1=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H17ClN2O4S/c1-2-28-22(27)19-20(26)18(30-21(19)25-15-6-4-3-5-7-15)13-14-8-9-17(16(23)12-14)29-11-10-24/h3-9,12-13,25H,2,11H2,1H3/b18-13-