5-(4-dimethylaminophenyl)-3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-dimethylaminophenyl)-3-(4-fluorophenyl)-4-(3-methylphenyl)carbonyl-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-dimethylaminophenyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-dimethylaminophenyl)-3-(4-fluorophenyl)-4-[(3-methylphenyl)-oxomethyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-dimethylaminophenyl)-3-(4-fluorophenyl)-4-(3-methylbenzoyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-dimethylaminophenyl)-3-(4-fluorophenyl)-4-m-toluoyl-1-(2-thenoyl)proline Formula: C32H29FN2O4S MolecularWeight: 556.647063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=CC=C(C=C3)N(C)C)C(=O)C4=CC=CS4)C(=O)O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2C(C(N(C2C3=CC=C(C=C3)N(C)C)C(=O)C4=CC=CS4)C(=O)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C32H29FN2O4S/c1-19-6-4-7-22(18-19)30(36)27-26(20-9-13-23(33)14-10-20)29(32(38)39)35(31(37)25-8-5-17-40-25)28(27)21-11-15-24(16-12-21)34(2)3/h4-18,26-29H,1-3H3,(H,38,39)