3-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-isobutyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)ethyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-isobutyl-1H-1,2,4-triazole-5-thione Formula: C13H20BrN5S MolecularWeight: 358.3004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC2=NNC(=S)N2CC(C)C)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCC2=NNC(=S)N2CC(C)C)C)Br

InChI

InChI=1S/C13H20BrN5S/c1-8(2)7-18-11(15-16-13(18)20)5-6-19-10(4)12(14)9(3)17-19/h8H,5-7H2,1-4H3,(H,16,20)