5-[4-chloranyl-2-(5-methylsulfonylpyridin-2-yl)-5-(trifluoromethyl)pyrazol-3-yl]-2-thiophen-2-yl-benzenecarbonitrile

Systemtic Name: 5-[4-chloranyl-2-(5-methylsulfonylpyridin-2-yl)-5-(trifluoromethyl)pyrazol-3-yl]-2-thiophen-2-yl-benzenecarbonitrile Openeye Name: 5-[4-chloro-2-(5-methylsulfonyl-2-pyridyl)-5-(trifluoromethyl)pyrazol-3-yl]-2-(2-thienyl)benzonitrile CAS Name: 5-[4-chloro-2-(5-methylsulfonyl-2-pyridinyl)-5-(trifluoromethyl)-3-pyrazolyl]-2-thiophen-2-ylbenzonitrile IUPAC Name: 5-[4-chloro-2-(5-methylsulfonylpyridin-2-yl)-5-(trifluoromethyl)pyrazol-3-yl]-2-thiophen-2-ylbenzonitrile Traditional Name: 5-[4-chloro-2-(5-mesyl-2-pyridyl)-5-(trifluoromethyl)pyrazol-3-yl]-2-(2-thienyl)benzonitrile Formula: C21H12ClF3N4O2S2 MolecularWeight: 508.92379

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)(F)F)Cl)C3=CC(=C(C=C3)C4=CC=CS4)C#N

Isomeric SMILES

CS(=O)(=O)C1=CN=C(C=C1)N2C(=C(C(=N2)C(F)(F)F)Cl)C3=CC(=C(C=C3)C4=CC=CS4)C#N

InChI

InChI=1S/C21H12ClF3N4O2S2/c1-33(30,31)14-5-7-17(27-11-14)29-19(18(22)20(28-29)21(23,24)25)12-4-6-15(13(9-12)10-26)16-3-2-8-32-16/h2-9,11H,1H3