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

Systemtic Name: 4-phenyl-3-[[[3-(trifluoromethyl)phenyl]amino]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-phenyl-3-[[3-(trifluoromethyl)anilino]methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-phenyl-3-[[3-(trifluoromethyl)anilino]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-phenyl-3-[[3-(trifluoromethyl)anilino]methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-phenyl-3-[[3-(trifluoromethyl)anilino]methyl]-1H-1,2,4-triazole-5-thione Formula: C16H13F3N4S MolecularWeight: 350.36143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CNC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CNC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H13F3N4S/c17-16(18,19)11-5-4-6-12(9-11)20-10-14-21-22-15(24)23(14)13-7-2-1-3-8-13/h1-9,20H,10H2,(H,22,24)