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

Systemtic Name: 3-(3-fluoranyl-4-methoxy-phenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Openeye Name: 3-(3-fluoro-4-methoxy-phenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide CAS Name: 3-(3-fluoro-4-methoxyphenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: 3-(3-fluoro-4-methoxyphenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Traditional Name: 3-(3-fluoro-4-methoxy-phenyl)-6-prop-1-ynyl-2-(1H-pyrazol-5-yl)-4-(trifluoromethyl)benzenesulfonamide Formula: C20H15F4N3O3S MolecularWeight: 453.410013

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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)F)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C20H15F4N3O3S/c1-3-4-12-9-13(20(22,23)24)17(11-5-6-16(30-2)14(21)10-11)18(15-7-8-26-27-15)19(12)31(25,28)29/h5-10H,1-2H3,(H,26,27)(H2,25,28,29)