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

Systemtic Name: 4-azanyl-3-[2-(1-butyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-[2-(1-butyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-[2-(1-butyl-3,5-dimethyl-4-pyrazolyl)ethyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-[2-(1-butyl-3,5-dimethylpyrazol-4-yl)ethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-[2-(1-butyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-1H-1,2,4-triazole-5-thione Formula: C13H22N6S MolecularWeight: 294.41898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)CCC2=NNC(=S)N2N)C

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)CCC2=NNC(=S)N2N)C

InChI

InChI=1S/C13H22N6S/c1-4-5-8-18-10(3)11(9(2)17-18)6-7-12-15-16-13(20)19(12)14/h4-8,14H2,1-3H3,(H,16,20)