4-butyl-5-(4-chloranyl-1,5-dimethyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-butyl-5-(4-chloranyl-1,5-dimethyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate Openeye Name: 4-butyl-5-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate CAS Name: 4-butyl-5-(4-chloro-1,5-dimethyl-3-pyrazolyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-butyl-5-(4-chloro-1,5-dimethylpyrazol-3-yl)-1,2,4-triazole-3-thiolate Traditional Name: 4-butyl-5-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-1,2,4-triazole-3-thiolate Formula: C11H15ClN5S- MolecularWeight: 284.7883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1[S-])C2=NN(C(=C2Cl)C)C

Isomeric SMILES

CCCCN1C(=NN=C1[S-])C2=NN(C(=C2Cl)C)C

InChI

InChI=1S/C11H16ClN5S/c1-4-5-6-17-10(13-14-11(17)18)9-8(12)7(2)16(3)15-9/h4-6H2,1-3H3,(H,14,18)/p-1