2-(5-methylsulfonylpyridin-2-yl)-3-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2-(5-methylsulfonylpyridin-2-yl)-3-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-(5-methylsulfonyl-2-pyridyl)-3-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzonitrile CAS Name: 2-(5-methylsulfonyl-2-pyridinyl)-3-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-(5-methylsulfonylpyridin-2-yl)-3-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzonitrile Traditional Name: 2-(5-mesyl-2-pyridyl)-3-(1H-pyrazol-5-yl)-5-(trifluoromethyl)benzonitrile Formula: C17H11F3N4O2S MolecularWeight: 392.35505

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=C(C=C1)C2=C(C=C(C=C2C#N)C(F)(F)F)C3=CC=NN3

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)C2=C(C=C(C=C2C#N)C(F)(F)F)C3=CC=NN3

InChI

InChI=1S/C17H11F3N4O2S/c1-27(25,26)12-2-3-15(22-9-12)16-10(8-21)6-11(17(18,19)20)7-13(16)14-4-5-23-24-14/h2-7,9H,1H3,(H,23,24)