4-(6-bromanyl-2-fluoranyl-3-methyl-phenyl)-3-butyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(6-bromanyl-2-fluoranyl-3-methyl-phenyl)-3-butyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(6-bromo-2-fluoro-3-methyl-phenyl)-3-butyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(6-bromo-2-fluoro-3-methylphenyl)-3-butyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(6-bromo-2-fluoro-3-methylphenyl)-3-butyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(6-bromo-2-fluoro-3-methyl-phenyl)-3-butyl-1H-1,2,4-triazole-5-thione Formula: C13H15BrFN3S MolecularWeight: 344.245703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NNC(=S)N1C2=C(C=CC(=C2F)C)Br

Isomeric SMILES

CCCCC1=NNC(=S)N1C2=C(C=CC(=C2F)C)Br

InChI

InChI=1S/C13H15BrFN3S/c1-3-4-5-10-16-17-13(19)18(10)12-9(14)7-6-8(2)11(12)15/h6-7H,3-5H2,1-2H3,(H,17,19)