(2S)-2-(2-bromophenyl)sulfanyl-N-[(2S)-2-cyano-3-methyl-butan-2-yl]propanamide

Systemtic Name: (2S)-2-(2-bromophenyl)sulfanyl-N-[(2S)-2-cyano-3-methyl-butan-2-yl]propanamide Openeye Name: (2S)-2-(2-bromophenyl)sulfanyl-N-[(1S)-1-cyano-1,2-dimethyl-propyl]propanamide CAS Name: (2S)-2-[(2-bromophenyl)thio]-N-[(2S)-2-cyano-3-methylbutan-2-yl]propanamide IUPAC Name: (2S)-2-(2-bromophenyl)sulfanyl-N-[(2S)-2-cyano-3-methylbutan-2-yl]propanamide Traditional Name: (2S)-2-[(2-bromophenyl)thio]-N-[(1S)-1-cyano-1,2-dimethyl-propyl]propionamide Formula: C15H19BrN2OS MolecularWeight: 355.29316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C(C)SC1=CC=CC=C1Br

Isomeric SMILES

C[C@@H](C(=O)N[C@](C)(C#N)C(C)C)SC1=CC=CC=C1Br

InChI

InChI=1S/C15H19BrN2OS/c1-10(2)15(4,9-17)18-14(19)11(3)20-13-8-6-5-7-12(13)16/h5-8,10-11H,1-4H3,(H,18,19)/t11-,15+/m0/s1