2-(cyanomethylsulfanyl)-N-(1-oxidanylbutan-2-yl)benzamide

Systemtic Name: 2-(cyanomethylsulfanyl)-N-(1-oxidanylbutan-2-yl)benzamide Openeye Name: 2-(cyanomethylsulfanyl)-N-[1-(hydroxymethyl)propyl]benzamide CAS Name: 2-(cyanomethylthio)-N-(1-hydroxybutan-2-yl)benzamide IUPAC Name: 2-(cyanomethylsulfanyl)-N-(1-hydroxybutan-2-yl)benzamide Traditional Name: 2-(cyanomethylthio)-N-(1-methylolpropyl)benzamide Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)C1=CC=CC=C1SCC#N

Isomeric SMILES

CCC(CO)NC(=O)C1=CC=CC=C1SCC#N

InChI

InChI=1S/C13H16N2O2S/c1-2-10(9-16)15-13(17)11-5-3-4-6-12(11)18-8-7-14/h3-6,10,16H,2,8-9H2,1H3,(H,15,17)