6-(cyanomethyl)-2-(1H-pyrazol-5-yl)-3-pyridin-4-yl-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 6-(cyanomethyl)-2-(1H-pyrazol-5-yl)-3-pyridin-4-yl-4-(trifluoromethyl)benzenesulfonamide Openeye Name: 6-(cyanomethyl)-2-(1H-pyrazol-5-yl)-3-(4-pyridyl)-4-(trifluoromethyl)benzenesulfonamide CAS Name: 6-(cyanomethyl)-2-(1H-pyrazol-5-yl)-3-pyridin-4-yl-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: 6-(cyanomethyl)-2-(1H-pyrazol-5-yl)-3-pyridin-4-yl-4-(trifluoromethyl)benzenesulfonamide Traditional Name: 6-(cyanomethyl)-2-(1H-pyrazol-5-yl)-3-(4-pyridyl)-4-(trifluoromethyl)benzenesulfonamide Formula: C17H12F3N5O2S MolecularWeight: 407.36969

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=C(C(=C(C=C2C(F)(F)F)CC#N)S(=O)(=O)N)C3=CC=NN3

Isomeric SMILES

C1=CN=CC=C1C2=C(C(=C(C=C2C(F)(F)F)CC#N)S(=O)(=O)N)C3=CC=NN3

InChI

InChI=1S/C17H12F3N5O2S/c18-17(19,20)12-9-11(1-5-21)16(28(22,26)27)15(13-4-8-24-25-13)14(12)10-2-6-23-7-3-10/h2-4,6-9H,1H2,(H,24,25)(H2,22,26,27)