5-(4-chloranyl-1-methyl-pyrazol-3-yl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-chloranyl-1-methyl-pyrazol-3-yl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-chloro-1-methyl-pyrazol-3-yl)-4-isobutyl-1,2,4-triazole-3-thiolate CAS Name: 5-(4-chloro-1-methyl-3-pyrazolyl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-chloro-1-methylpyrazol-3-yl)-4-(2-methylpropyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-chloro-1-methyl-pyrazol-3-yl)-4-isobutyl-1,2,4-triazole-3-thiolate Formula: C10H13ClN5S- MolecularWeight: 270.76172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1[S-])C2=NN(C=C2Cl)C

Isomeric SMILES

CC(C)CN1C(=NN=C1[S-])C2=NN(C=C2Cl)C

InChI

InChI=1S/C10H14ClN5S/c1-6(2)4-16-9(12-13-10(16)17)8-7(11)5-15(3)14-8/h5-6H,4H2,1-3H3,(H,13,17)/p-1