(phenylmethyl) N-[2-[[2-(3-bromophenyl)ethanoylamino]-(phenylmethyl)amino]ethanoyl-(2-methylpropyl)amino]carbamate

Systemtic Name: (phenylmethyl) N-[2-[[2-(3-bromophenyl)ethanoylamino]-(phenylmethyl)amino]ethanoyl-(2-methylpropyl)amino]carbamate Openeye Name: benzyl N-[[2-[benzyl-[[2-(3-bromophenyl)acetyl]amino]amino]acetyl]-isobutyl-amino]carbamate CAS Name: N-[[2-[[[2-(3-bromophenyl)-1-oxoethyl]amino]-(phenylmethyl)amino]-1-oxoethyl]-(2-methylpropyl)amino]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[[2-[benzyl-[[2-(3-bromophenyl)acetyl]amino]amino]acetyl]-(2-methylpropyl)amino]carbamate Traditional Name: N-[[2-[benzyl-[[2-(3-bromophenyl)acetyl]amino]amino]acetyl]-isobutyl-amino]carbamic acid benzyl ester Formula: C29H33BrN4O4 MolecularWeight: 581.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(=O)CN(CC1=CC=CC=C1)NC(=O)CC2=CC(=CC=C2)Br)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN(C(=O)CN(CC1=CC=CC=C1)NC(=O)CC2=CC(=CC=C2)Br)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H33BrN4O4/c1-22(2)18-34(32-29(37)38-21-24-12-7-4-8-13-24)28(36)20-33(19-23-10-5-3-6-11-23)31-27(35)17-25-14-9-15-26(30)16-25/h3-16,22H,17-21H2,1-2H3,(H,31,35)(H,32,37)