4-amino-5-(3-methyl-5-phenyl-1H-pyrazol-1-yl)-4H-1,2,4-triazole-3-thiol
4-amino-3-(3-methyl-5-phenylpyrazol-1-yl)-1H-1,2,4-triazole-5-thione
Also Known As: Oprea1_589848|AB00106436-01|AN-655/14022003|SR-01000502970-1|4-amino-5-(3-methyl-5-phenyl-1H-pyrazol-1-yl)-4H-1,2,4-triazole-3-thiol|4-amino-3-(3-methyl-5-phenylpyrazol-1-yl)-1H-1,2,4-triazole-5-thione|4-amino-5-(3-methyl-5-phenyl-1-pyrazolyl)-4H-1,2,4-triazole-3-thiol|4-Amino-3-(3-methyl-5-phenyl-1H-pyrazol-1-yl)-1H-1,2,4-triazole-5(4H)-thione|4-amino-3-(3-methyl-5-phenyl-1H-pyrazol-1-yl)-4,5-dihydro-1H-1,2,4-triazole-5-thione|4-Amino-3-(5-phenyl-3-methyl-1H-pyrazol-1-yl)-1H-1,2,4-triazole-5(4H)-thione|4-amino-5-(3-methyl-5-phenyl-1H-pyrazol-1-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
| Molecular Formula | C12H12N6S |
|---|---|
| Molecular Weight | 272.0844 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.0844 |
| Monoisotopic Mass | 272.0844 |
| Heavy Atoms | 19 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 83031-64-5 |
|---|---|
| SMILES | CC1=NN(C(=C1)C2=CC=CC=C2)C3=NNC(=S)N3N |
| InChIKey | JGCXBHRWEUVLGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-amino-5-(3-methyl-5-phenyl-1H-pyrazol-1-yl)-4H-1,2,4-triazole-3-thiol (CAS 83031-64-5), with molecular formula C12H12N6S and molecular weight 272.0844 g/mol. IUPAC: 4-amino-3-(3-methyl-5-phenylpyrazol-1-yl)-1H-1,2,4-triazole-5-thione.
4-amino-5-(3-methyl-5-phenyl-1H-pyrazol-1-yl)-4H-1,2,4-triazole-3-thiol is a custom synthesis product. We offer services from milligram to kilogram scale.
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