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

Systemtic Name: 1-cyclopropylcarbonyl-5-(4-fluorophenyl)-4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-4-(2-methylbenzoyl)-3-(3-methyl-2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[cyclopropyl(oxo)methyl]-5-(4-fluorophenyl)-4-[(2-methylphenyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-4-(2-methylbenzoyl)-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-3-(3-methyl-2-thienyl)-4-o-toluoyl-proline Formula: C28H26FNO4S MolecularWeight: 491.573743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)O)C(=O)C3CC3)C4=CC=C(C=C4)F)C(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)O)C(=O)C3CC3)C4=CC=C(C=C4)F)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C28H26FNO4S/c1-15-5-3-4-6-20(15)25(31)21-22(26-16(2)13-14-35-26)24(28(33)34)30(27(32)18-7-8-18)23(21)17-9-11-19(29)12-10-17/h3-6,9-14,18,21-24H,7-8H2,1-2H3,(H,33,34)