N-(1-oxidanylbutan-2-yl)-2-phenethylsulfanyl-ethanamide

Systemtic Name: N-(1-oxidanylbutan-2-yl)-2-phenethylsulfanyl-ethanamide Openeye Name: N-[1-(hydroxymethyl)propyl]-2-phenethylsulfanyl-acetamide CAS Name: N-(1-hydroxybutan-2-yl)-2-(phenethylthio)acetamide IUPAC Name: N-(1-hydroxybutan-2-yl)-2-phenethylsulfanylacetamide Traditional Name: N-(1-methylolpropyl)-2-(phenethylthio)acetamide Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)CSCCC1=CC=CC=C1

Isomeric SMILES

CCC(CO)NC(=O)CSCCC1=CC=CC=C1

InChI

InChI=1S/C14H21NO2S/c1-2-13(10-16)15-14(17)11-18-9-8-12-6-4-3-5-7-12/h3-7,13,16H,2,8-11H2,1H3,(H,15,17)