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

Systemtic Name: 1-(3-fluorophenyl)carbonyl-2-methyl-4-(2-methylphenyl)carbonyl-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-fluorobenzoyl)-2-methyl-4-(2-methylbenzoyl)-3,5-bis(3-methyl-2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-fluorophenyl)-oxomethyl]-2-methyl-4-[(2-methylphenyl)-oxomethyl]-3,5-bis(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-fluorobenzoyl)-2-methyl-4-(2-methylbenzoyl)-3,5-bis(3-methylthiophen-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(3-fluorobenzoyl)-2-methyl-3,5-bis(3-methyl-2-thienyl)-4-o-toluoyl-proline Formula: C31H28FNO4S2 MolecularWeight: 561.686723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2(C)C(=O)O)C(=O)C3=CC(=CC=C3)F)C4=C(C=CS4)C)C(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2(C)C(=O)O)C(=O)C3=CC(=CC=C3)F)C4=C(C=CS4)C)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C31H28FNO4S2/c1-17-8-5-6-11-22(17)26(34)23-24(27-18(2)12-14-38-27)31(4,30(36)37)33(25(23)28-19(3)13-15-39-28)29(35)20-9-7-10-21(32)16-20/h5-16,23-25H,1-4H3,(H,36,37)