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

Systemtic Name: (2S)-4-methyl-N-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-2-(2-sulfanylethylsulfanyl)pentanamide Openeye Name: (2S)-N-[1-benzyl-2-(methylamino)-2-oxo-ethyl]-4-methyl-2-(2-sulfanylethylsulfanyl)pentanamide CAS Name: (2S)-2-(2-mercaptoethylthio)-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]pentanamide IUPAC Name: (2S)-4-methyl-N-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]-2-(2-sulfanylethylsulfanyl)pentanamide Traditional Name: (2S)-N-[1-benzyl-2-keto-2-(methylamino)ethyl]-2-(2-mercaptoethylthio)-4-methyl-valeramide Formula: C18H28N2O2S2 MolecularWeight: 368.55712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC)SCCS

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(CC1=CC=CC=C1)C(=O)NC)SCCS

InChI

InChI=1S/C18H28N2O2S2/c1-13(2)11-16(24-10-9-23)18(22)20-15(17(21)19-3)12-14-7-5-4-6-8-14/h4-8,13,15-16,23H,9-12H2,1-3H3,(H,19,21)(H,20,22)/t15?,16-/m0/s1