N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[4-(1-pyrazolyl)-2-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[4-pyrazol-1-yl-2-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C18H14F3N3O4S MolecularWeight: 425.38167

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=C(C=C(C=C3)N4C=CC=N4)C(F)(F)F

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=C(C=C(C=C3)N4C=CC=N4)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O4S/c19-18(20,21)14-10-12(24-7-1-6-22-24)2-4-15(14)23-29(25,26)13-3-5-16-17(11-13)28-9-8-27-16/h1-7,10-11,23H,8-9H2