5-(4-chlorophenyl)-1-cyclohexylcarbonyl-4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)-1-cyclohexylcarbonyl-4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-4-(2-methylbenzoyl)-3-(3-methyl-2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-chlorophenyl)-1-[cyclohexyl(oxo)methyl]-4-[(2-methylphenyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-4-(2-methylbenzoyl)-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-3-(3-methyl-2-thienyl)-4-o-toluoyl-proline Formula: C31H32ClNO4S MolecularWeight: 550.10808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)O)C(=O)C3CCCCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)O)C(=O)C3CCCCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C31H32ClNO4S/c1-18-8-6-7-11-23(18)28(34)24-25(29-19(2)16-17-38-29)27(31(36)37)33(30(35)21-9-4-3-5-10-21)26(24)20-12-14-22(32)15-13-20/h6-8,11-17,21,24-27H,3-5,9-10H2,1-2H3,(H,36,37)