ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[3-(4-ethoxy-3-methoxyphenyl)-1-oxopropyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-ethoxy-3-methoxyphenyl)propanoylamino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[3-(4-ethoxy-3-methoxy-phenyl)propanoylamino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H27NO5S MolecularWeight: 453.55058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCC(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC)OC

InChI

InChI=1S/C25H27NO5S/c1-4-30-20-13-11-17(15-21(20)29-3)12-14-22(27)26-24-23(25(28)31-5-2)19(16-32-24)18-9-7-6-8-10-18/h6-11,13,15-16H,4-5,12,14H2,1-3H3,(H,26,27)