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

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-bromanyl-4-methylsulfonyl-pyrazole-3-carbonitrile Openeye Name: 5-bromo-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-pyrazole-3-carbonitrile CAS Name: 5-bromo-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-3-pyrazolecarbonitrile IUPAC Name: 5-bromo-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonylpyrazole-3-carbonitrile Traditional Name: 5-bromo-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-mesyl-pyrazole-3-carbonitrile Formula: C12H5BrCl2F3N3O2S MolecularWeight: 463.05721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)Br

Isomeric SMILES

CS(=O)(=O)C1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)Br

InChI

InChI=1S/C12H5BrCl2F3N3O2S/c1-24(22,23)10-8(4-19)20-21(11(10)13)9-6(14)2-5(3-7(9)15)12(16,17)18/h2-3H,1H3