N-(1-methylsulfanyl-2-oxidanylidene-4-phenyl-pentyl)-2-(3-phenylpropanoylamino)pentanamide

Systemtic Name: N-(1-methylsulfanyl-2-oxidanylidene-4-phenyl-pentyl)-2-(3-phenylpropanoylamino)pentanamide Openeye Name: N-(1-methylsulfanyl-2-oxo-4-phenyl-pentyl)-2-(3-phenylpropanoylamino)pentanamide CAS Name: N-[1-(methylthio)-2-oxo-4-phenylpentyl]-2-[(1-oxo-3-phenylpropyl)amino]pentanamide IUPAC Name: N-(1-methylsulfanyl-2-oxo-4-phenylpentyl)-2-(3-phenylpropanoylamino)pentanamide Traditional Name: 2-(hydrocinnamoylamino)-N-[2-keto-1-(methylthio)-4-phenyl-pentyl]valeramide Formula: C26H34N2O3S MolecularWeight: 454.62476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(C(=O)CC(C)C1=CC=CC=C1)SC)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCCC(C(=O)NC(C(=O)CC(C)C1=CC=CC=C1)SC)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C26H34N2O3S/c1-4-11-22(27-24(30)17-16-20-12-7-5-8-13-20)25(31)28-26(32-3)23(29)18-19(2)21-14-9-6-10-15-21/h5-10,12-15,19,22,26H,4,11,16-18H2,1-3H3,(H,27,30)(H,28,31)