5-(4-cyanophenyl)-4-(4-methylphenyl)carbonyl-1-(2-phenoxyethanoyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-cyanophenyl)-4-(4-methylphenyl)carbonyl-1-(2-phenoxyethanoyl)-3-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-cyanophenyl)-4-(4-methylbenzoyl)-1-(2-phenoxyacetyl)-3-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-cyanophenyl)-4-[(4-methylphenyl)-oxomethyl]-1-(1-oxo-2-phenoxyethyl)-3-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-cyanophenyl)-4-(4-methylbenzoyl)-1-(2-phenoxyacetyl)-3-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 5-(4-cyanophenyl)-1-(2-phenoxyacetyl)-4-p-toluoyl-3-(2-thienyl)proline Formula: C32H26N2O5S MolecularWeight: 550.62424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)COC4=CC=CC=C4)C(=O)O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2C(C(N(C2C3=CC=C(C=C3)C#N)C(=O)COC4=CC=CC=C4)C(=O)O)C5=CC=CS5

InChI

InChI=1S/C32H26N2O5S/c1-20-9-13-23(14-10-20)31(36)28-27(25-8-5-17-40-25)30(32(37)38)34(26(35)19-39-24-6-3-2-4-7-24)29(28)22-15-11-21(18-33)12-16-22/h2-17,27-30H,19H2,1H3,(H,37,38)