4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-2-(2-phenylethanethioylamino)pentanamide

Systemtic Name: 4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-2-(2-phenylethanethioylamino)pentanamide Openeye Name: N-[1-benzyl-2-(methylamino)-2-oxo-ethyl]-4-methyl-2-[(2-phenylethanethioyl)amino]pentanamide CAS Name: 4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-2-[(2-phenyl-1-sulfanylideneethyl)amino]pentanamide IUPAC Name: 4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-2-[(2-phenylethanethioyl)amino]pentanamide Traditional Name: N-[1-benzyl-2-keto-2-(methylamino)ethyl]-4-methyl-2-[(2-phenylthioacetyl)amino]valeramide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)NC(=S)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)NC(=S)CC2=CC=CC=C2

InChI

InChI=1S/C24H31N3O2S/c1-17(2)14-20(26-22(30)16-19-12-8-5-9-13-19)24(29)27-21(23(28)25-3)15-18-10-6-4-7-11-18/h4-13,17,20-21H,14-16H2,1-3H3,(H,25,28)(H,26,30)(H,27,29)