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

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-5-methyl-2-(2-methylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-5-methyl-2-(2-methylpropanoylamino)thiophene-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-5-methyl-2-[(2-methyl-1-oxopropyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-5-methyl-2-(2-methylpropanoylamino)thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-(isobutyrylamino)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO5S/c1-7-26-20(23)17-16(12(4)27-19(17)21-18(22)11(2)3)13-8-9-14(24-5)15(10-13)25-6/h8-11H,7H2,1-6H3,(H,21,22)