N-[4-[(2S)-butan-2-yl]phenyl]-2-(cyanomethylsulfanyl)benzamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(cyanomethylsulfanyl)benzamide Openeye Name: 2-(cyanomethylsulfanyl)-N-[4-[(1S)-1-methylpropyl]phenyl]benzamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(cyanomethylthio)benzamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(cyanomethylsulfanyl)benzamide Traditional Name: 2-(cyanomethylthio)-N-[4-[(1S)-1-methylpropyl]phenyl]benzamide Formula: C19H20N2OS MolecularWeight: 324.4399

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC#N

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC#N

InChI

InChI=1S/C19H20N2OS/c1-3-14(2)15-8-10-16(11-9-15)21-19(22)17-6-4-5-7-18(17)23-13-12-20/h4-11,14H,3,13H2,1-2H3,(H,21,22)/t14-/m0/s1