3-(4-tert-butylphenyl)-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1-(phenylcarbamoyl)-5-styryl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-3-(4-tert-butylphenyl)-4-[oxo(thiophen-2-yl)methyl]-5-(2-phenylethenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1-(phenylcarbamoyl)-5-(2-phenylethenyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1-(phenylcarbamoyl)-5-styryl-4-(2-thenoyl)proline Formula: C35H34N2O4S MolecularWeight: 578.72046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)NC3=CC=CC=C3)C=CC4=CC=CC=C4)C(=O)C5=CC=CS5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)NC3=CC=CC=C3)C=CC4=CC=CC=C4)C(=O)C5=CC=CS5

InChI

InChI=1S/C35H34N2O4S/c1-35(2,3)25-19-17-24(18-20-25)29-30(32(38)28-15-10-22-42-28)27(21-16-23-11-6-4-7-12-23)37(31(29)33(39)40)34(41)36-26-13-8-5-9-14-26/h4-22,27,29-31H,1-3H3,(H,36,41)(H,39,40)