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

Systemtic Name: 3-(3-phenyl-1H-pyrazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-phenyl-1H-pyrazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-(3-phenyl-1H-pyrazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3-phenyl-1H-pyrazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-phenyl-1H-pyrazol-5-yl)-4-[2-(trifluoromethyl)phenyl]-1H-1,2,4-triazole-5-thione Formula: C18H12F3N5S MolecularWeight: 387.38159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=C2)C3=NNC(=S)N3C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=C2)C3=NNC(=S)N3C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C18H12F3N5S/c19-18(20,21)12-8-4-5-9-15(12)26-16(24-25-17(26)27)14-10-13(22-23-14)11-6-2-1-3-7-11/h1-10H,(H,22,23)(H,25,27)