5-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione Openeye Name: 5-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione CAS Name: 5-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione IUPAC Name: 5-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione Traditional Name: 5-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3-thione Formula: C10H3F6N3S MolecularWeight: 311.206339

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NC(=S)N=N2

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NC(=S)N=N2

InChI

InChI=1S/C10H3F6N3S/c11-9(12,13)5-1-4(7-17-8(20)19-18-7)2-6(3-5)10(14,15)16/h1-3H