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

Systemtic Name: 5-(4-chlorophenyl)-4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)-1-morpholin-4-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 5-(4-chlorophenyl)-4-(2-methylbenzoyl)-3-(3-methyl-2-thienyl)-1-(morpholine-4-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-chlorophenyl)-4-[(2-methylphenyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-1-[4-morpholinyl(oxo)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(4-chlorophenyl)-4-(2-methylbenzoyl)-3-(3-methylthiophen-2-yl)-1-(morpholine-4-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 5-(4-chlorophenyl)-3-(3-methyl-2-thienyl)-1-(morpholine-4-carbonyl)-4-o-toluoyl-proline Formula: C29H29ClN2O5S MolecularWeight: 553.06896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)O)C(=O)N3CCOCC3)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)N3CCOCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C29H29ClN2O5S/c1-17-5-3-4-6-21(17)26(33)22-23(27-18(2)11-16-38-27)25(28(34)35)32(29(36)31-12-14-37-15-13-31)24(22)19-7-9-20(30)10-8-19/h3-11,16,22-25H,12-15H2,1-2H3,(H,34,35)