4-[3-[bis(fluoranyl)methyl]-5-(4-methylphenyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide

Systemtic Name: 4-[3-[bis(fluoranyl)methyl]-5-(4-methylphenyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide Openeye Name: 4-[3-(difluoromethyl)-5-(p-tolyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide CAS Name: 4-[3-(difluoromethyl)-5-(4-methylphenyl)-1-pyrazolyl]-2-(hydroxymethyl)benzenesulfonamide IUPAC Name: 4-[3-(difluoromethyl)-5-(4-methylphenyl)pyrazol-1-yl]-2-(hydroxymethyl)benzenesulfonamide Traditional Name: 4-[3-(difluoromethyl)-5-(p-tolyl)pyrazol-1-yl]-2-methylol-benzenesulfonamide Formula: C18H17F2N3O3S MolecularWeight: 393.407686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)N)CO)C(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)N)CO)C(F)F

InChI

InChI=1S/C18H17F2N3O3S/c1-11-2-4-12(5-3-11)16-9-15(18(19)20)22-23(16)14-6-7-17(27(21,25)26)13(8-14)10-24/h2-9,18,24H,10H2,1H3,(H2,21,25,26)