ethyl 5-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-2-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl 5-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-2-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl 5-[(4-allyloxy-3-methoxy-phenyl)methylene]-2-[(4-methylbenzoyl)amino]-4-oxo-thiophene-3-carboxylate CAS Name: 5-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-2-[[(4-methylphenyl)-oxomethyl]amino]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-2-[(4-methylbenzoyl)amino]-4-oxothiophene-3-carboxylate Traditional Name: 5-(4-allyloxy-3-methoxy-benzylidene)-4-keto-2-(p-toluoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C26H25NO6S MolecularWeight: 479.5448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)OCC=C)OC)C1=O)NC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)OCC=C)OC)C1=O)NC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H25NO6S/c1-5-13-33-19-12-9-17(14-20(19)31-4)15-21-23(28)22(26(30)32-6-2)25(34-21)27-24(29)18-10-7-16(3)8-11-18/h5,7-12,14-15H,1,6,13H2,2-4H3,(H,27,29)