(2S)-2-azanyl-N-(3-bromanyl-4-methyl-phenyl)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-(3-bromanyl-4-methyl-phenyl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-amino-N-(3-bromo-4-methyl-phenyl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-(3-bromo-4-methylphenyl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-(3-bromo-4-methylphenyl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-N-(3-bromo-4-methyl-phenyl)-4-(methylthio)butyramide Formula: C12H17BrN2OS MolecularWeight: 317.24518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(CCSC)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](CCSC)N)Br

InChI

InChI=1S/C12H17BrN2OS/c1-8-3-4-9(7-10(8)13)15-12(16)11(14)5-6-17-2/h3-4,7,11H,5-6,14H2,1-2H3,(H,15,16)/t11-/m0/s1