3-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(1-oxidanylbutan-2-yl)propanamide

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(1-oxidanylbutan-2-yl)propanamide Openeye Name: 3-(3,4-difluorophenyl)sulfanyl-N-[1-(hydroxymethyl)propyl]propanamide CAS Name: 3-[(3,4-difluorophenyl)thio]-N-(1-hydroxybutan-2-yl)propanamide IUPAC Name: 3-(3,4-difluorophenyl)sulfanyl-N-(1-hydroxybutan-2-yl)propanamide Traditional Name: 3-[(3,4-difluorophenyl)thio]-N-(1-methylolpropyl)propionamide Formula: C13H17F2NO2S MolecularWeight: 289.341386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)CCSC1=CC(=C(C=C1)F)F

Isomeric SMILES

CCC(CO)NC(=O)CCSC1=CC(=C(C=C1)F)F

InChI

InChI=1S/C13H17F2NO2S/c1-2-9(8-17)16-13(18)5-6-19-10-3-4-11(14)12(15)7-10/h3-4,7,9,17H,2,5-6,8H2,1H3,(H,16,18)