AC1OAKIS
4-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione
Also Known As: SR-01000252715-1|BRD-K86194042-001-01-1|4-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione|4-{[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]amino}-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol|4-[(1E)-2-(1-methylpyrrol-2-yl)-1-azavinyl]-5-(phenoxymethyl)-1,2,4-triazole-3 -thiol|(E)-4-(((1-methyl-1H-pyrrol-2-yl)methylene)amino)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol
| Molecular Formula | C15H15N5OS |
|---|---|
| Molecular Weight | 313.09973 g/mol |
| LogP | 2.74039 |
| Topological Polar Surface Area | 60.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.09973 |
| Monoisotopic Mass | 313.09973 |
| Heavy Atoms | 22 |
| Complexity | 830.9973 |
Chemical Identifiers
| CAS Number | 496797-41-2 |
|---|---|
| SMILES | CN1C=CC=C1/C=N/N2C(=NNC2=S)COC3=CC=CC=C3 |
Product Overview
AC1OAKIS (CAS 496797-41-2), with molecular formula C15H15N5OS and molecular weight 313.09973 g/mol. IUPAC: 4-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione.
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