4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(2-methylbenzoyl)-3-(3-methyl-2-thienyl)-1-(phenylcarbamoyl)-5-styryl-pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-4-[(2-methylphenyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-5-(2-phenylethenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(2-methylbenzoyl)-3-(3-methylthiophen-2-yl)-1-(phenylcarbamoyl)-5-(2-phenylethenyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(3-methyl-2-thienyl)-4-o-toluoyl-1-(phenylcarbamoyl)-5-styryl-proline Formula: C33H30N2O4S MolecularWeight: 550.6673

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)O)C(=O)NC3=CC=CC=C3)C=CC4=CC=CC=C4)C(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)O)C(=O)NC3=CC=CC=C3)C=CC4=CC=CC=C4)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C33H30N2O4S/c1-21-11-9-10-16-25(21)30(36)27-26(18-17-23-12-5-3-6-13-23)35(33(39)34-24-14-7-4-8-15-24)29(32(37)38)28(27)31-22(2)19-20-40-31/h3-20,26-29H,1-2H3,(H,34,39)(H,37,38)