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

Systemtic Name: 5-methyl-3-phenyl-4-[[2-(trifluoromethyl)phenyl]diazenyl]pyrazole-1-carbodithioic acid Openeye Name: 5-methyl-3-phenyl-4-[2-(trifluoromethyl)phenyl]azo-pyrazole-1-carbodithioic acid CAS Name: 5-methyl-3-phenyl-4-[2-(trifluoromethyl)phenyl]azo-1-pyrazolecarbodithioic acid IUPAC Name: 5-methyl-3-phenyl-4-[[2-(trifluoromethyl)phenyl]diazenyl]pyrazole-1-carbodithioic acid Traditional Name: 5-methyl-3-phenyl-4-[2-(trifluoromethyl)phenyl]azo-pyrazole-1-carbodithioic acid Formula: C18H13F3N4S2 MolecularWeight: 406.44783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=S)S)C2=CC=CC=C2)N=NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=C(C(=NN1C(=S)S)C2=CC=CC=C2)N=NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H13F3N4S2/c1-11-15(23-22-14-10-6-5-9-13(14)18(19,20)21)16(24-25(11)17(26)27)12-7-3-2-4-8-12/h2-10H,1H3,(H,26,27)