(phenylmethyl) N-[(2S)-4-methyl-1-oxidanylidene-1-[2-[[[(2S)-2-(phenylmethoxycarbonylamino)butanoyl]amino]carbamoyl]hydrazinyl]pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-4-methyl-1-oxidanylidene-1-[2-[[[(2S)-2-(phenylmethoxycarbonylamino)butanoyl]amino]carbamoyl]hydrazinyl]pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[[[[(2S)-2-(benzyloxycarbonylamino)butanoyl]amino]carbamoylamino]carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-4-methyl-1-oxo-1-[[oxo-[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)butyl]hydrazo]methyl]hydrazo]pentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-4-methyl-1-oxo-1-[2-[[[(2S)-2-(phenylmethoxycarbonylamino)butanoyl]amino]carbamoyl]hydrazinyl]pentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[[[(2S)-2-(benzyloxycarbonylamino)butanoyl]amino]carbamoylamino]carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C27H36N6O7 MolecularWeight: 556.61074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NNC(=O)NNC(=O)C(CC(C)C)NC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC[C@@H](C(=O)NNC(=O)NNC(=O)[C@H](CC(C)C)NC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C27H36N6O7/c1-4-21(28-26(37)39-16-19-11-7-5-8-12-19)23(34)30-32-25(36)33-31-24(35)22(15-18(2)3)29-27(38)40-17-20-13-9-6-10-14-20/h5-14,18,21-22H,4,15-17H2,1-3H3,(H,28,37)(H,29,38)(H,30,34)(H,31,35)(H2,32,33,36)/t21-,22-/m0/s1