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

Systemtic Name: 3-methyl-4-[2,3,4-tris(fluoranyl)phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-methyl-4-(2,3,4-trifluorophenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-(2,3,4-trifluorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-(2,3,4-trifluorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-(2,3,4-trifluorophenyl)-1H-1,2,4-triazole-5-thione Formula: C9H6F3N3S MolecularWeight: 245.22425

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

CC1=NNC(=S)N1C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C9H6F3N3S/c1-4-13-14-9(16)15(4)6-3-2-5(10)7(11)8(6)12/h2-3H,1H3,(H,14,16)