4-[3-[bis(fluoranyl)methyl]-7-methylsulfanyl-benzo[g]indazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-[bis(fluoranyl)methyl]-7-methylsulfanyl-benzo[g]indazol-1-yl]benzenesulfonamide Openeye Name: 4-[3-(difluoromethyl)-7-methylsulfanyl-benzo[g]indazol-1-yl]benzenesulfonamide CAS Name: 4-[3-(difluoromethyl)-7-(methylthio)-1-benzo[g]indazolyl]benzenesulfonamide IUPAC Name: 4-[3-(difluoromethyl)-7-methylsulfanylbenzo[g]indazol-1-yl]benzenesulfonamide Traditional Name: 4-[3-(difluoromethyl)-7-(methylthio)benz[g]indazol-1-yl]benzenesulfonamide Formula: C19H15F2N3O2S2 MolecularWeight: 419.468106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)C3=C(C=C2)C(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)F

Isomeric SMILES

CSC1=CC2=C(C=C1)C3=C(C=C2)C(=NN3C4=CC=C(C=C4)S(=O)(=O)N)C(F)F

InChI

InChI=1S/C19H15F2N3O2S2/c1-27-13-5-9-15-11(10-13)2-8-16-17(19(20)21)23-24(18(15)16)12-3-6-14(7-4-12)28(22,25)26/h2-10,19H,1H3,(H2,22,25,26)