N-[(1-ethylpyrazol-4-yl)methyl]-3,4-bis(fluoranyl)benzenesulfonamide

Systemtic Name: N-[(1-ethylpyrazol-4-yl)methyl]-3,4-bis(fluoranyl)benzenesulfonamide Openeye Name: N-[(1-ethylpyrazol-4-yl)methyl]-3,4-difluoro-benzenesulfonamide CAS Name: N-[(1-ethyl-4-pyrazolyl)methyl]-3,4-difluorobenzenesulfonamide IUPAC Name: N-[(1-ethylpyrazol-4-yl)methyl]-3,4-difluorobenzenesulfonamide Traditional Name: N-[(1-ethylpyrazol-4-yl)methyl]-3,4-difluoro-benzenesulfonamide Formula: C12H13F2N3O2S MolecularWeight: 301.312326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNS(=O)(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

CCN1C=C(C=N1)CNS(=O)(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C12H13F2N3O2S/c1-2-17-8-9(6-15-17)7-16-20(18,19)10-3-4-11(13)12(14)5-10/h3-6,8,16H,2,7H2,1H3