ethyl 2-[3-(4-tert-butylphenyl)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-tert-butylphenyl)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-tert-butylphenyl)propanoylamino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[3-(4-tert-butylphenyl)-1-oxopropyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-tert-butylphenyl)propanoylamino]-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[3-(4-tert-butylphenyl)propanoylamino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C27H31NO3S MolecularWeight: 449.60494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)CCC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)CCC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H31NO3S/c1-6-31-26(30)24-22(20-12-7-18(2)8-13-20)17-32-25(24)28-23(29)16-11-19-9-14-21(15-10-19)27(3,4)5/h7-10,12-15,17H,6,11,16H2,1-5H3,(H,28,29)