4-methyl-N-(4-methylsulfanyl-3-oxidanylidene-1-phenyl-butan-2-yl)-2-(3-phenylpropanoylamino)pentanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)CSC)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)CSC)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C26H34N2O3S/c1-19(2)16-23(27-25(30)15-14-20-10-6-4-7-11-20)26(31)28-22(24(29)18-32-3)17-21-12-8-5-9-13-21/h4-13,19,22-23H,14-18H2,1-3H3,(H,27,30)(H,28,31)