AC1OC0U2
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-(2-ethoxyphenyl)methylideneamino]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(((4-chlorophenyl)thio)methyl)-N'-(2-ethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-(2-ethoxyphenyl)methylideneamino]triazole-4-carboxamide|1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-(2-ethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C21H19ClN8O3S |
|---|---|
| Molecular Weight | 498.09894 g/mol |
| LogP | 3.3408 |
| Topological Polar Surface Area | 146.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 498.09894 |
| Monoisotopic Mass | 498.09894 |
| Heavy Atoms | 34 |
| Complexity | 1305.6082 |
Chemical Identifiers
| CAS Number | 849005-64-7 |
|---|---|
| SMILES | CCOC1=CC=CC=C1/C=N/NC(=O)C2=C(N(N=N2)C3=NON=C3N)CSC4=CC=C(C=C4)Cl |
Product Overview
AC1OC0U2 (CAS 849005-64-7), with molecular formula C21H19ClN8O3S and molecular weight 498.09894 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-(2-ethoxyphenyl)methylideneamino]triazole-4-carboxamide.
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