(phenylmethyl) N-[(2S)-1-oxidanylidene-6-[(3-oxidanylidene-3-phenyl-propanoyl)amino]-1-phenylazanyl-hexan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-oxidanylidene-6-[(3-oxidanylidene-3-phenyl-propanoyl)amino]-1-phenylazanyl-hexan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-5-[(3-oxo-3-phenyl-propanoyl)amino]-1-(phenylcarbamoyl)pentyl]carbamate CAS Name: N-[(2S)-1-anilino-6-[(1,3-dioxo-3-phenylpropyl)amino]-1-oxohexan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-anilino-1-oxo-6-[(3-oxo-3-phenylpropanoyl)amino]hexan-2-yl]carbamate Traditional Name: N-[(1S)-5-[(3-keto-3-phenyl-propanoyl)amino]-1-(phenylcarbamoyl)pentyl]carbamic acid benzyl ester Formula: C29H31N3O5 MolecularWeight: 501.57354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCNC(=O)CC(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@@H](CCCCNC(=O)CC(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C29H31N3O5/c33-26(23-14-6-2-7-15-23)20-27(34)30-19-11-10-18-25(28(35)31-24-16-8-3-9-17-24)32-29(36)37-21-22-12-4-1-5-13-22/h1-9,12-17,25H,10-11,18-21H2,(H,30,34)(H,31,35)(H,32,36)/t25-/m0/s1