tert-butyl 5-[(4-chlorophenyl)carbonylamino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylate

Systemtic Name: tert-butyl 5-[(4-chlorophenyl)carbonylamino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylate Openeye Name: tert-butyl 5-[(4-chlorobenzoyl)amino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylate CAS Name: 5-[[(4-chlorophenyl)-oxomethyl]amino]-2-(dimethylamino)-3-phenyl-4-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[(4-chlorobenzoyl)amino]-2-(dimethylamino)-3-phenylimidazole-4-carboxylate Traditional Name: 5-[(4-chlorobenzoyl)amino]-2-(dimethylamino)-3-phenyl-imidazole-4-carboxylic acid tert-butyl ester Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(N=C(N1C2=CC=CC=C2)N(C)C)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(N=C(N1C2=CC=CC=C2)N(C)C)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN4O3/c1-23(2,3)31-21(30)18-19(25-20(29)15-11-13-16(24)14-12-15)26-22(27(4)5)28(18)17-9-7-6-8-10-17/h6-14H,1-5H3,(H,25,29)