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

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-methylsulfonyl-phenyl]-3-(trifluoromethyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(2,6-dichloro-4-methylsulfonyl-phenyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(2,6-dichloro-4-methylsulfonylphenyl)-3-(trifluoromethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2,6-dichloro-4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(2,6-dichloro-4-mesyl-phenyl)-3-(trifluoromethyl)pyrazole-4-carbonitrile Formula: C12H7Cl2F3N4O2S MolecularWeight: 399.17579

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C(=C1)Cl)N2C(=C(C(=N2)C(F)(F)F)C#N)N)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C(=C1)Cl)N2C(=C(C(=N2)C(F)(F)F)C#N)N)Cl

InChI

InChI=1S/C12H7Cl2F3N4O2S/c1-24(22,23)5-2-7(13)9(8(14)3-5)21-11(19)6(4-18)10(20-21)12(15,16)17/h2-3H,19H2,1H3