(phenylmethyl) N-[(2S)-1-[2-(benzamidocarbamoyl)hydrazinyl]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[2-(benzamidocarbamoyl)hydrazinyl]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(benzamidocarbamoylamino)carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-[[(benzoylhydrazo)-oxomethyl]hydrazo]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[2-(benzamidocarbamoyl)hydrazinyl]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(benzamidocarbamoylamino)carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C22H27N5O5 MolecularWeight: 441.48028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NNC(=O)NNC(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NNC(=O)NNC(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27N5O5/c1-15(2)13-18(23-22(31)32-14-16-9-5-3-6-10-16)20(29)25-27-21(30)26-24-19(28)17-11-7-4-8-12-17/h3-12,15,18H,13-14H2,1-2H3,(H,23,31)(H,24,28)(H,25,29)(H2,26,27,30)/t18-/m0/s1