(2S)-2-azanyl-4-methylsulfanyl-N-[2-(phenylmethylsulfanyl)propanoyl]butanamide

Systemtic Name: (2S)-2-azanyl-4-methylsulfanyl-N-[2-(phenylmethylsulfanyl)propanoyl]butanamide Openeye Name: (2S)-2-amino-N-(2-benzylsulfanylpropanoyl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-4-(methylthio)-N-[1-oxo-2-(phenylmethylthio)propyl]butanamide IUPAC Name: (2S)-2-amino-N-(2-benzylsulfanylpropanoyl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-N-[2-(benzylthio)propanoyl]-4-(methylthio)butyramide Formula: C15H22N2O2S2 MolecularWeight: 326.47738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)C(CCSC)N)SCC1=CC=CC=C1

Isomeric SMILES

CC(C(=O)NC(=O)[C@H](CCSC)N)SCC1=CC=CC=C1

InChI

InChI=1S/C15H22N2O2S2/c1-11(21-10-12-6-4-3-5-7-12)14(18)17-15(19)13(16)8-9-20-2/h3-7,11,13H,8-10,16H2,1-2H3,(H,17,18,19)/t11?,13-/m0/s1