ethyl 5-[(3-bromophenyl)methylidene]-2-[(4-methoxyphenyl)amino]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl 5-[(3-bromophenyl)methylidene]-2-[(4-methoxyphenyl)amino]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl 5-[(3-bromophenyl)methylene]-2-(4-methoxyanilino)-4-oxo-thiophene-3-carboxylate CAS Name: 5-[(3-bromophenyl)methylidene]-2-(4-methoxyanilino)-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-bromophenyl)methylidene]-2-(4-methoxyanilino)-4-oxothiophene-3-carboxylate Traditional Name: 5-(3-bromobenzylidene)-4-keto-2-(p-anisidino)thiophene-3-carboxylic acid ethyl ester Formula: C21H18BrNO4S MolecularWeight: 460.34092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18BrNO4S/c1-3-27-21(25)18-19(24)17(12-13-5-4-6-14(22)11-13)28-20(18)23-15-7-9-16(26-2)10-8-15/h4-12,23H,3H2,1-2H3