ethyl 4-(3,4-dimethoxyphenyl)-5-methyl-2-(phenylcarbonylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-5-methyl-2-(phenylcarbonylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 2-(benzoylcarbamothioylamino)-4-(3,4-dimethoxyphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[benzamido(sulfanylidene)methyl]amino]-4-(3,4-dimethoxyphenyl)-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzoylcarbamothioylamino)-4-(3,4-dimethoxyphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-(benzoylthiocarbamoylamino)-4-(3,4-dimethoxyphenyl)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H24N2O5S2 MolecularWeight: 484.58776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)OC)OC)C)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC(=C(C=C2)OC)OC)C)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H24N2O5S2/c1-5-31-23(28)20-19(16-11-12-17(29-3)18(13-16)30-4)14(2)33-22(20)26-24(32)25-21(27)15-9-7-6-8-10-15/h6-13H,5H2,1-4H3,(H2,25,26,27,32)