(2S)-2-azanyl-4-methylsulfanyl-N-(2-oxidanylidene-2-phenylazanyl-ethyl)butanamide

Systemtic Name: (2S)-2-azanyl-4-methylsulfanyl-N-(2-oxidanylidene-2-phenylazanyl-ethyl)butanamide Openeye Name: (2S)-2-amino-N-(2-anilino-2-oxo-ethyl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-(2-anilino-2-oxoethyl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-(2-anilino-2-oxoethyl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-N-(2-anilino-2-keto-ethyl)-4-(methylthio)butyramide Formula: C13H19N3O2S MolecularWeight: 281.37386

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC(=O)NC1=CC=CC=C1)N

Isomeric SMILES

CSCC[C@@H](C(=O)NCC(=O)NC1=CC=CC=C1)N

InChI

InChI=1S/C13H19N3O2S/c1-19-8-7-11(14)13(18)15-9-12(17)16-10-5-3-2-4-6-10/h2-6,11H,7-9,14H2,1H3,(H,15,18)(H,16,17)/t11-/m0/s1