(2S)-3-methyl-N-[(3S)-2-oxidanylidene-5-phenyl-1-phenylmethoxy-pentan-3-yl]-2-(2-pyridin-3-ylethanoylamino)pentanamide

Systemtic Name: (2S)-3-methyl-N-[(3S)-2-oxidanylidene-5-phenyl-1-phenylmethoxy-pentan-3-yl]-2-(2-pyridin-3-ylethanoylamino)pentanamide Openeye Name: (2S)-N-[(1S)-3-benzyloxy-2-oxo-1-phenethyl-propyl]-3-methyl-2-[[2-(3-pyridyl)acetyl]amino]pentanamide CAS Name: (2S)-3-methyl-N-[(3S)-2-oxo-5-phenyl-1-phenylmethoxypentan-3-yl]-2-[[1-oxo-2-(3-pyridinyl)ethyl]amino]pentanamide IUPAC Name: (2S)-3-methyl-N-[(3S)-2-oxo-5-phenyl-1-phenylmethoxypentan-3-yl]-2-[(2-pyridin-3-ylacetyl)amino]pentanamide Traditional Name: (2S)-N-[(1S)-3-benzoxy-2-keto-1-phenethyl-propyl]-3-methyl-2-[[2-(3-pyridyl)acetyl]amino]valeramide Formula: C31H37N3O4 MolecularWeight: 515.64318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCC1=CC=CC=C1)C(=O)COCC2=CC=CC=C2)NC(=O)CC3=CN=CC=C3

Isomeric SMILES

CCC(C)[C@@H](C(=O)N[C@@H](CCC1=CC=CC=C1)C(=O)COCC2=CC=CC=C2)NC(=O)CC3=CN=CC=C3

InChI

InChI=1S/C31H37N3O4/c1-3-23(2)30(34-29(36)19-26-15-10-18-32-20-26)31(37)33-27(17-16-24-11-6-4-7-12-24)28(35)22-38-21-25-13-8-5-9-14-25/h4-15,18,20,23,27,30H,3,16-17,19,21-22H2,1-2H3,(H,33,37)(H,34,36)/t23?,27-,30-/m0/s1