1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfonyl)pyrazole-3-carbonitrile

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfonyl)pyrazole-3-carbonitrile Openeye Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfonyl)pyrazole-3-carbonitrile CAS Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfonyl)-3-pyrazolecarbonitrile IUPAC Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-(trifluoromethylsulfonyl)pyrazole-3-carbonitrile Traditional Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-triflyl-pyrazole-3-carbonitrile Formula: C12H3Cl2F6N3O2S MolecularWeight: 438.132539

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C=C(C(=N2)C#N)S(=O)(=O)C(F)(F)F)Cl)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C=C(C(=N2)C#N)S(=O)(=O)C(F)(F)F)Cl)C(F)(F)F

InChI

InChI=1S/C12H3Cl2F6N3O2S/c13-6-1-5(11(15,16)17)2-7(14)10(6)23-4-9(8(3-21)22-23)26(24,25)12(18,19)20/h1-2,4H