3-[7-(trifluoromethyl)quinolin-4-yl]sulfanyl-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[7-(trifluoromethyl)quinolin-4-yl]sulfanyl-1H-1,2,4-triazol-5-amine Openeye Name: 3-[[7-(trifluoromethyl)-4-quinolyl]sulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[[7-(trifluoromethyl)-4-quinolinyl]thio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[7-(trifluoromethyl)quinolin-4-yl]sulfanyl-1H-1,2,4-triazol-5-amine Traditional Name: [3-[[7-(trifluoromethyl)-4-quinolyl]thio]-1H-1,2,4-triazol-5-yl]amine Formula: C12H8F3N5S MolecularWeight: 311.28563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2C=C1C(F)(F)F)SC3=NNC(=N3)N

Isomeric SMILES

C1=CC2=C(C=CN=C2C=C1C(F)(F)F)SC3=NNC(=N3)N

InChI

InChI=1S/C12H8F3N5S/c13-12(14,15)6-1-2-7-8(5-6)17-4-3-9(7)21-11-18-10(16)19-20-11/h1-5H,(H3,16,18,19,20)