(2S)-3-methyl-N-[(3S)-1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]-2-(3-phenylpropanoylamino)pentanamide

Systemtic Name: (2S)-3-methyl-N-[(3S)-1-oxidanyl-2-oxidanylidene-5-phenyl-pentan-3-yl]-2-(3-phenylpropanoylamino)pentanamide Openeye Name: (2S)-N-[(1S)-3-hydroxy-2-oxo-1-phenethyl-propyl]-3-methyl-2-(3-phenylpropanoylamino)pentanamide CAS Name: (2S)-N-[(3S)-1-hydroxy-2-oxo-5-phenylpentan-3-yl]-3-methyl-2-[(1-oxo-3-phenylpropyl)amino]pentanamide IUPAC Name: (2S)-N-[(3S)-1-hydroxy-2-oxo-5-phenylpentan-3-yl]-3-methyl-2-(3-phenylpropanoylamino)pentanamide Traditional Name: (2S)-2-(hydrocinnamoylamino)-N-[(1S)-3-hydroxy-2-keto-1-phenethyl-propyl]-3-methyl-valeramide Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCC1=CC=CC=C1)C(=O)CO)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCC(C)[C@@H](C(=O)N[C@@H](CCC1=CC=CC=C1)C(=O)CO)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C26H34N2O4/c1-3-19(2)25(28-24(31)17-15-21-12-8-5-9-13-21)26(32)27-22(23(30)18-29)16-14-20-10-6-4-7-11-20/h4-13,19,22,25,29H,3,14-18H2,1-2H3,(H,27,32)(H,28,31)/t19?,22-,25-/m0/s1