3-(methylsulfanylmethyl)-N-(1-oxidanylbutan-2-yl)benzamide

Systemtic Name: 3-(methylsulfanylmethyl)-N-(1-oxidanylbutan-2-yl)benzamide Openeye Name: N-[1-(hydroxymethyl)propyl]-3-(methylsulfanylmethyl)benzamide CAS Name: N-(1-hydroxybutan-2-yl)-3-[(methylthio)methyl]benzamide IUPAC Name: N-(1-hydroxybutan-2-yl)-3-(methylsulfanylmethyl)benzamide Traditional Name: N-(1-methylolpropyl)-3-[(methylthio)methyl]benzamide Formula: C13H19NO2S MolecularWeight: 253.36046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)C1=CC(=CC=C1)CSC

Isomeric SMILES

CCC(CO)NC(=O)C1=CC(=CC=C1)CSC

InChI

InChI=1S/C13H19NO2S/c1-3-12(8-15)14-13(16)11-6-4-5-10(7-11)9-17-2/h4-7,12,15H,3,8-9H2,1-2H3,(H,14,16)