4-aminocarbonyl-1-(4-tert-butylphenyl)carbonyl-5-(1-methylimidazol-2-yl)-2-(2-methylpropyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-aminocarbonyl-1-(4-tert-butylphenyl)carbonyl-5-(1-methylimidazol-2-yl)-2-(2-methylpropyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(4-tert-butylbenzoyl)-4-carbamoyl-2-isobutyl-5-(1-methylimidazol-2-yl)pyrrolidine-2-carboxylic acid CAS Name: 1-[(4-tert-butylphenyl)-oxomethyl]-4-carbamoyl-5-(1-methyl-2-imidazolyl)-2-(2-methylpropyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(4-tert-butylbenzoyl)-4-carbamoyl-5-(1-methylimidazol-2-yl)-2-(2-methylpropyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(4-tert-butylbenzoyl)-4-carbamoyl-2-isobutyl-5-(1-methylimidazol-2-yl)proline Formula: C25H34N4O4 MolecularWeight: 454.56186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CC(C(N1C(=O)C2=CC=C(C=C2)C(C)(C)C)C3=NC=CN3C)C(=O)N)C(=O)O

Isomeric SMILES

CC(C)CC1(CC(C(N1C(=O)C2=CC=C(C=C2)C(C)(C)C)C3=NC=CN3C)C(=O)N)C(=O)O

InChI

InChI=1S/C25H34N4O4/c1-15(2)13-25(23(32)33)14-18(20(26)30)19(21-27-11-12-28(21)6)29(25)22(31)16-7-9-17(10-8-16)24(3,4)5/h7-12,15,18-19H,13-14H2,1-6H3,(H2,26,30)(H,32,33)