tert-butyl 2-[[5-[(phenylmethyl)carbamoyl]-1H-imidazol-4-yl]carbonylamino]ethanoate

Systemtic Name: tert-butyl 2-[[5-[(phenylmethyl)carbamoyl]-1H-imidazol-4-yl]carbonylamino]ethanoate Openeye Name: tert-butyl 2-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]acetate CAS Name: 2-[[oxo-[5-[oxo-[(phenylmethyl)amino]methyl]-1H-imidazol-4-yl]methyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]acetate Traditional Name: 2-[[5-(benzylcarbamoyl)-1H-imidazole-4-carbonyl]amino]acetic acid tert-butyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNC(=O)C1=C(NC=N1)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CNC(=O)C1=C(NC=N1)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O4/c1-18(2,3)26-13(23)10-20-17(25)15-14(21-11-22-15)16(24)19-9-12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3,(H,19,24)(H,20,25)(H,21,22)