4-(4-butoxyphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 4-(4-butoxyphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide Openeye Name: 4-(4-butoxyphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide CAS Name: 4-(4-butoxyphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide IUPAC Name: 4-(4-butoxyphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide Traditional Name: 4-(4-butoxyphenyl)-2-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenesulfonamide Formula: C20H20F3N3O3S MolecularWeight: 439.45131

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2C(F)(F)F)S(=O)(=O)N)C3=CC=NN3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2C(F)(F)F)S(=O)(=O)N)C3=CC=NN3

InChI

InChI=1S/C20H20F3N3O3S/c1-2-3-10-29-14-6-4-13(5-7-14)15-11-16(18-8-9-25-26-18)19(30(24,27)28)12-17(15)20(21,22)23/h4-9,11-12H,2-3,10H2,1H3,(H,25,26)(H2,24,27,28)