5-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 5-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Openeye Name: 5-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide CAS Name: 5-(3,4-dimethoxyphenyl)-2-(1-pyrazolyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: 5-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Traditional Name: 5-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Formula: C18H16F3N3O4S MolecularWeight: 427.39755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C(C(=C2)S(=O)(=O)N)N3C=CC=N3)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C(C(=C2)S(=O)(=O)N)N3C=CC=N3)C(F)(F)F)OC

InChI

InChI=1S/C18H16F3N3O4S/c1-27-14-5-4-11(9-15(14)28-2)12-8-13(18(19,20)21)17(24-7-3-6-23-24)16(10-12)29(22,25)26/h3-10H,1-2H3,(H2,22,25,26)