(phenylmethyl) N-[1-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-[(1-carbamoyl-3-methyl-butyl)amino]-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[(1-carbamoyl-3-methyl-butyl)amino]-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]carbamic acid benzyl ester Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)C(CC1=CN=CN1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)C(CC1=CN=CN1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H27N5O4/c1-13(2)8-16(18(21)26)24-19(27)17(9-15-10-22-12-23-15)25-20(28)29-11-14-6-4-3-5-7-14/h3-7,10,12-13,16-17H,8-9,11H2,1-2H3,(H2,21,26)(H,22,23)(H,24,27)(H,25,28)