(phenylmethyl) N-[(2S)-1-[2-(3-azanyl-3-oxidanylidene-propyl)-2-(2-bromanylethanoyl)hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[2-(3-azanyl-3-oxidanylidene-propyl)-2-(2-bromanylethanoyl)hydrazinyl]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-[2-(3-amino-3-oxo-propyl)-2-(2-bromoacetyl)hydrazino]-1-benzyl-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[2-(3-amino-3-oxopropyl)-2-(2-bromo-1-oxoethyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[2-(3-amino-3-oxopropyl)-2-(2-bromoacetyl)hydrazinyl]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[N'-(3-amino-3-keto-propyl)-N'-(2-bromoacetyl)hydrazino]-1-benzyl-2-keto-ethyl]carbamic acid benzyl ester Formula: C22H25BrN4O5 MolecularWeight: 505.3617

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NN(CCC(=O)N)C(=O)CBr)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NN(CCC(=O)N)C(=O)CBr)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25BrN4O5/c23-14-20(29)27(12-11-19(24)28)26-21(30)18(13-16-7-3-1-4-8-16)25-22(31)32-15-17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H2,24,28)(H,25,31)(H,26,30)/t18-/m0/s1