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

Systemtic Name: 4-butyl-3-(4-chloranyl-1,5-dimethyl-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-butyl-3-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-butyl-3-(4-chloro-1,5-dimethyl-3-pyrazolyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-butyl-3-(4-chloro-1,5-dimethylpyrazol-3-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-butyl-3-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Formula: C11H16ClN5S MolecularWeight: 285.79624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NNC1=S)C2=NN(C(=C2Cl)C)C

Isomeric SMILES

CCCCN1C(=NNC1=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)