4-[(4-methylphenyl)diazenyl]-3-thiophen-2-yl-5-(trifluoromethyl)pyrazole-1-carbodithioic acid

Systemtic Name: 4-[(4-methylphenyl)diazenyl]-3-thiophen-2-yl-5-(trifluoromethyl)pyrazole-1-carbodithioic acid Openeye Name: 4-(p-tolylazo)-3-(2-thienyl)-5-(trifluoromethyl)pyrazole-1-carbodithioic acid CAS Name: 4-(4-methylphenyl)azo-3-thiophen-2-yl-5-(trifluoromethyl)-1-pyrazolecarbodithioic acid IUPAC Name: 4-[(4-methylphenyl)diazenyl]-3-thiophen-2-yl-5-(trifluoromethyl)pyrazole-1-carbodithioic acid Traditional Name: 4-(p-tolylazo)-3-(2-thienyl)-5-(trifluoromethyl)pyrazole-1-carbodithioic acid Formula: C16H11F3N4S3 MolecularWeight: 412.47555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=NC2=C(N(N=C2C3=CC=CS3)C(=S)S)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)N=NC2=C(N(N=C2C3=CC=CS3)C(=S)S)C(F)(F)F

InChI

InChI=1S/C16H11F3N4S3/c1-9-4-6-10(7-5-9)20-21-13-12(11-3-2-8-26-11)22-23(15(24)25)14(13)16(17,18)19/h2-8H,1H3,(H,24,25)