4-[(4-nitrophenyl)methyl]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(4-nitrophenyl)methyl]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(4-nitrophenyl)methyl]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(4-nitrophenyl)methyl]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(4-nitrophenyl)methyl]-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-nitrobenzyl)-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione Formula: C10H7F3N4O2S MolecularWeight: 304.24839

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=NNC2=S)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C(=NNC2=S)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C10H7F3N4O2S/c11-10(12,13)8-14-15-9(20)16(8)5-6-1-3-7(4-2-6)17(18)19/h1-4H,5H2,(H,15,20)