5-[4-(dimethylamino)-3-fluoranyl-phenyl]-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 5-[4-(dimethylamino)-3-fluoranyl-phenyl]-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Openeye Name: 5-[4-(dimethylamino)-3-fluoro-phenyl]-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide CAS Name: 5-[4-(dimethylamino)-3-fluorophenyl]-2-(1-pyrazolyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: 5-[4-(dimethylamino)-3-fluorophenyl]-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Traditional Name: 5-[4-(dimethylamino)-3-fluoro-phenyl]-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Formula: C18H16F4N4O2S MolecularWeight: 428.403853

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C2=CC(=C(C(=C2)S(=O)(=O)N)N3C=CC=N3)C(F)(F)F)F

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C2=CC(=C(C(=C2)S(=O)(=O)N)N3C=CC=N3)C(F)(F)F)F

InChI

InChI=1S/C18H16F4N4O2S/c1-25(2)15-5-4-11(9-14(15)19)12-8-13(18(20,21)22)17(26-7-3-6-24-26)16(10-12)29(23,27)28/h3-10H,1-2H3,(H2,23,27,28)