tert-butyl 4-[[4-[(4-chlorophenyl)carbamoyl]-1H-imidazol-5-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[(4-chlorophenyl)carbamoyl]-1H-imidazol-5-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-[(4-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[(4-chloroanilino)-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-[(4-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-[(4-chlorophenyl)carbamoyl]-1H-imidazole-5-carbonyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H26ClN5O4 MolecularWeight: 447.91524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2=C(N=CN2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2=C(N=CN2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H26ClN5O4/c1-21(2,3)31-20(30)27-10-8-15(9-11-27)26-19(29)17-16(23-12-24-17)18(28)25-14-6-4-13(22)5-7-14/h4-7,12,15H,8-11H2,1-3H3,(H,23,24)(H,25,28)(H,26,29)