3,5-dimethyl-4-[[2-(trifluoromethyl)phenyl]diazenyl]pyrazole-1-carbodithioic acid

Systemtic Name: 3,5-dimethyl-4-[[2-(trifluoromethyl)phenyl]diazenyl]pyrazole-1-carbodithioic acid Openeye Name: 3,5-dimethyl-4-[2-(trifluoromethyl)phenyl]azo-pyrazole-1-carbodithioic acid CAS Name: 3,5-dimethyl-4-[2-(trifluoromethyl)phenyl]azo-1-pyrazolecarbodithioic acid IUPAC Name: 3,5-dimethyl-4-[[2-(trifluoromethyl)phenyl]diazenyl]pyrazole-1-carbodithioic acid Traditional Name: 3,5-dimethyl-4-[2-(trifluoromethyl)phenyl]azo-pyrazole-1-carbodithioic acid Formula: C13H11F3N4S2 MolecularWeight: 344.37845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=S)S)C)N=NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC1=C(C(=NN1C(=S)S)C)N=NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H11F3N4S2/c1-7-11(8(2)20(19-7)12(21)22)18-17-10-6-4-3-5-9(10)13(14,15)16/h3-6H,1-2H3,(H,21,22)