tert-butyl 2-azanyl-4-[3-[(phenylmethyl)carbamoylamino]propyl]imidazole-1-carboxylate

Systemtic Name: tert-butyl 2-azanyl-4-[3-[(phenylmethyl)carbamoylamino]propyl]imidazole-1-carboxylate Openeye Name: tert-butyl 2-amino-4-[3-(benzylcarbamoylamino)propyl]imidazole-1-carboxylate CAS Name: 2-amino-4-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]propyl]-1-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-4-[3-(benzylcarbamoylamino)propyl]imidazole-1-carboxylate Traditional Name: 2-amino-4-[3-(benzylcarbamoylamino)propyl]imidazole-1-carboxylic acid tert-butyl ester Formula: C19H27N5O3 MolecularWeight: 373.44938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(N=C1N)CCCNC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(N=C1N)CCCNC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C19H27N5O3/c1-19(2,3)27-18(26)24-13-15(23-16(24)20)10-7-11-21-17(25)22-12-14-8-5-4-6-9-14/h4-6,8-9,13H,7,10-12H2,1-3H3,(H2,20,23)(H2,21,22,25)