3-(4-methoxy-3-methyl-phenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 3-(4-methoxy-3-methyl-phenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Openeye Name: 3-(4-methoxy-3-methyl-phenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide CAS Name: 3-(4-methoxy-3-methylphenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: 3-(4-methoxy-3-methylphenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Traditional Name: 3-(4-methoxy-3-methyl-phenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Formula: C21H18F3N3O3S MolecularWeight: 449.44613

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=C(C(=C1S(=O)(=O)N)C2=CC=NN2)C3=CC(=C(C=C3)OC)C)C(F)(F)F

Isomeric SMILES

CC#CC1=CC(=C(C(=C1S(=O)(=O)N)C2=CC=NN2)C3=CC(=C(C=C3)OC)C)C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3S/c1-4-5-14-11-15(21(22,23)24)18(13-6-7-17(30-3)12(2)10-13)19(16-8-9-26-27-16)20(14)31(25,28)29/h6-11H,1-3H3,(H,26,27)(H2,25,28,29)