1-[2-chloranyl-4-(trifluoromethyl)phenyl]-5-methylsulfonyl-pyrazole-4-carbonitrile

Systemtic Name: 1-[2-chloranyl-4-(trifluoromethyl)phenyl]-5-methylsulfonyl-pyrazole-4-carbonitrile Openeye Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-5-methylsulfonyl-pyrazole-4-carbonitrile CAS Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-5-methylsulfonyl-4-pyrazolecarbonitrile IUPAC Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-5-methylsulfonylpyrazole-4-carbonitrile Traditional Name: 1-[2-chloro-4-(trifluoromethyl)phenyl]-5-mesyl-pyrazole-4-carbonitrile Formula: C12H7ClF3N3O2S MolecularWeight: 349.71609

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=NN1C2=C(C=C(C=C2)C(F)(F)F)Cl)C#N

Isomeric SMILES

CS(=O)(=O)C1=C(C=NN1C2=C(C=C(C=C2)C(F)(F)F)Cl)C#N

InChI

InChI=1S/C12H7ClF3N3O2S/c1-22(20,21)11-7(5-17)6-18-19(11)10-3-2-8(4-9(10)13)12(14,15)16/h2-4,6H,1H3