ethyl 2-[3-(3,4-dimethoxyphenyl)propanoylamino]-5-ethyl-thiophene-3-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCC2=CC(=C(C=C2)OC)OC)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCC2=CC(=C(C=C2)OC)OC)C(=O)OCC

InChI

InChI=1S/C20H25NO5S/c1-5-14-12-15(20(23)26-6-2)19(27-14)21-18(22)10-8-13-7-9-16(24-3)17(11-13)25-4/h7,9,11-12H,5-6,8,10H2,1-4H3,(H,21,22)