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

Systemtic Name: 3-[3,4-bis(fluoranyl)phenyl]sulfanyl-N-(1H-pyrazol-4-yl)propanamide Openeye Name: 3-(3,4-difluorophenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide CAS Name: 3-[(3,4-difluorophenyl)thio]-N-(1H-pyrazol-4-yl)propanamide IUPAC Name: 3-(3,4-difluorophenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide Traditional Name: 3-[(3,4-difluorophenyl)thio]-N-(1H-pyrazol-4-yl)propionamide Formula: C12H11F2N3OS MolecularWeight: 283.297046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCCC(=O)NC2=CNN=C2)F)F

Isomeric SMILES

C1=CC(=C(C=C1SCCC(=O)NC2=CNN=C2)F)F

InChI

InChI=1S/C12H11F2N3OS/c13-10-2-1-9(5-11(10)14)19-4-3-12(18)17-8-6-15-16-7-8/h1-2,5-7H,3-4H2,(H,15,16)(H,17,18)