methyl 4-[(4-nitrophenyl)diazenyl]-3-thiophen-2-yl-5-(trifluoromethyl)pyrazole-1-carbodithioate

Systemtic Name: methyl 4-[(4-nitrophenyl)diazenyl]-3-thiophen-2-yl-5-(trifluoromethyl)pyrazole-1-carbodithioate Openeye Name: methyl 4-(4-nitrophenyl)azo-3-(2-thienyl)-5-(trifluoromethyl)pyrazole-1-carbodithioate CAS Name: 4-(4-nitrophenyl)azo-3-thiophen-2-yl-5-(trifluoromethyl)-1-pyrazolecarbodithioic acid methyl ester IUPAC Name: methyl 4-[(4-nitrophenyl)diazenyl]-3-thiophen-2-yl-5-(trifluoromethyl)pyrazole-1-carbodithioate Traditional Name: 4-(4-nitrophenyl)azo-3-(2-thienyl)-5-(trifluoromethyl)pyrazole-1-carbodithioic acid methyl ester Formula: C16H10F3N5O2S3 MolecularWeight: 457.47311

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=S)N1C(=C(C(=N1)C2=CC=CS2)N=NC3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CSC(=S)N1C(=C(C(=N1)C2=CC=CS2)N=NC3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C16H10F3N5O2S3/c1-28-15(27)23-14(16(17,18)19)13(12(22-23)11-3-2-8-29-11)21-20-9-4-6-10(7-5-9)24(25)26/h2-8H,1H3