ethyl 5-phenyl-2-[3-(4-propan-2-ylphenyl)propanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-[3-(4-propan-2-ylphenyl)propanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[3-(4-isopropylphenyl)propanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[1-oxo-3-(4-propan-2-ylphenyl)propyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-[3-(4-propan-2-ylphenyl)propanoylamino]thiophene-3-carboxylate Traditional Name: 2-(3-p-cumenylpropanoylamino)-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H27NO3S MolecularWeight: 421.55178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27NO3S/c1-4-29-25(28)21-16-22(20-8-6-5-7-9-20)30-24(21)26-23(27)15-12-18-10-13-19(14-11-18)17(2)3/h5-11,13-14,16-17H,4,12,15H2,1-3H3,(H,26,27)