3-[[4-[2-(2-aminocarbonylpyrrolidin-1-yl)-1-cyclopentyl-2-oxidanylidene-ethyl]phenyl]methyl]-2-butyl-5-chloranyl-imidazole-4-carboxylic acid

Systemtic Name: 3-[[4-[2-(2-aminocarbonylpyrrolidin-1-yl)-1-cyclopentyl-2-oxidanylidene-ethyl]phenyl]methyl]-2-butyl-5-chloranyl-imidazole-4-carboxylic acid Openeye Name: 2-butyl-3-[[4-[2-(2-carbamoylpyrrolidin-1-yl)-1-cyclopentyl-2-oxo-ethyl]phenyl]methyl]-5-chloro-imidazole-4-carboxylic acid CAS Name: 2-butyl-3-[[4-[2-(2-carbamoyl-1-pyrrolidinyl)-1-cyclopentyl-2-oxoethyl]phenyl]methyl]-5-chloro-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-3-[[4-[2-(2-carbamoylpyrrolidin-1-yl)-1-cyclopentyl-2-oxoethyl]phenyl]methyl]-5-chloroimidazole-4-carboxylic acid Traditional Name: 2-butyl-3-[4-[2-(2-carbamoylpyrrolidino)-1-cyclopentyl-2-keto-ethyl]benzyl]-5-chloro-imidazole-4-carboxylic acid Formula: C27H35ClN4O4 MolecularWeight: 515.0442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(C3CCCC3)C(=O)N4CCCC4C(=O)N)C(=O)O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C(C3CCCC3)C(=O)N4CCCC4C(=O)N)C(=O)O)Cl

InChI

InChI=1S/C27H35ClN4O4/c1-2-3-10-21-30-24(28)23(27(35)36)32(21)16-17-11-13-19(14-12-17)22(18-7-4-5-8-18)26(34)31-15-6-9-20(31)25(29)33/h11-14,18,20,22H,2-10,15-16H2,1H3,(H2,29,33)(H,35,36)