(phenylmethyl) N-[(2S)-4-methyl-1-oxidanylidene-1-[[(2S)-1-phenyl-3-phenylazanyl-propan-2-yl]amino]pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-4-methyl-1-oxidanylidene-1-[[(2S)-1-phenyl-3-phenylazanyl-propan-2-yl]amino]pentan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[[(1S)-1-(anilinomethyl)-2-phenyl-ethyl]carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-[[(2S)-1-anilino-3-phenylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[[(2S)-1-anilino-3-phenylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[(1S)-1-(anilinomethyl)-2-phenyl-ethyl]carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C29H35N3O3 MolecularWeight: 473.6065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)CNC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)CNC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H35N3O3/c1-22(2)18-27(32-29(34)35-21-24-14-8-4-9-15-24)28(33)31-26(19-23-12-6-3-7-13-23)20-30-25-16-10-5-11-17-25/h3-17,22,26-27,30H,18-21H2,1-2H3,(H,31,33)(H,32,34)/t26-,27-/m0/s1