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

Systemtic Name: 4-butyl-3-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-butyl-3-(4-chloro-2,5-dimethyl-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-butyl-3-(4-chloro-2,5-dimethyl-3-pyrazolyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-butyl-3-(4-chloro-2,5-dimethylpyrazol-3-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-butyl-3-(4-chloro-2,5-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=C(C(=NN2C)C)Cl

Isomeric SMILES

CCCCN1C(=NNC1=S)C2=C(C(=NN2C)C)Cl

InChI

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