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

Systemtic Name: tert-butyl 4-[[5-[(phenylmethyl)carbamoyl]-1H-imidazol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[5-[oxo-[(phenylmethyl)amino]methyl]-1H-imidazol-4-yl]methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H29N5O4 MolecularWeight: 427.49676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2=C(NC=N2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC(=O)C2=C(NC=N2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H29N5O4/c1-22(2,3)31-21(30)27-11-9-16(10-12-27)26-20(29)18-17(24-14-25-18)19(28)23-13-15-7-5-4-6-8-15/h4-8,14,16H,9-13H2,1-3H3,(H,23,28)(H,24,25)(H,26,29)