ethyl 3-[[2-(3,5-dimethoxyphenyl)-2-oxidanylidene-ethanethioyl]amino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[[2-(3,5-dimethoxyphenyl)-2-oxidanylidene-ethanethioyl]amino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(3,5-dimethoxyphenyl)-2-oxo-ethanethioyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-(3,5-dimethoxyphenyl)-2-oxo-1-sulfanylideneethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3,5-dimethoxyphenyl)-2-oxoethanethioyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(3,5-dimethoxyphenyl)-2-keto-thioacetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C23H21NO5S2 MolecularWeight: 455.54654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=S)C(=O)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=S)C(=O)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C23H21NO5S2/c1-4-29-23(26)21-18(13-19(31-21)14-8-6-5-7-9-14)24-22(30)20(25)15-10-16(27-2)12-17(11-15)28-3/h5-13H,4H2,1-3H3,(H,24,30)