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

Systemtic Name: 1-cyclohexylcarbonyl-3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-5-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)-5-(3-methyl-2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[cyclohexyl(oxo)methyl]-3-(4-fluorophenyl)-4-[(3-methylphenyl)-oxomethyl]-5-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)-5-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(cyclohexanecarbonyl)-3-(4-fluorophenyl)-5-(3-methyl-2-thienyl)-4-m-toluoyl-proline Formula: C31H32FNO4S MolecularWeight: 533.653483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CCCCC3)C(=O)O)C4=CC=C(C=C4)F)C(=O)C5=CC(=CC=C5)C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CCCCC3)C(=O)O)C4=CC=C(C=C4)F)C(=O)C5=CC(=CC=C5)C

InChI

InChI=1S/C31H32FNO4S/c1-18-7-6-10-22(17-18)28(34)25-24(20-11-13-23(32)14-12-20)27(31(36)37)33(26(25)29-19(2)15-16-38-29)30(35)21-8-4-3-5-9-21/h6-7,10-17,21,24-27H,3-5,8-9H2,1-2H3,(H,36,37)