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

Systemtic Name: 4-azanyl-3-[[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-[(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-[[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-[[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-[(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C12H20N6S MolecularWeight: 280.3924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC2=NNC(=S)N2N

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC2=NNC(=S)N2N

InChI

InChI=1S/C12H20N6S/c1-7(2)6-17-9(4)10(8(3)16-17)5-11-14-15-12(19)18(11)13/h7H,5-6,13H2,1-4H3,(H,15,19)