AC1O2I8N
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(((4-chlorophenyl)thio)methyl)-N'-(4-(diethylamino)benzylidene)-1H-1,2,3-triazole-4-carbohydrazide|1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]triazole-4-carboxamide|1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-{(E)-[4-(diethylamino)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C23H24ClN9O2S |
|---|---|
| Molecular Weight | 525.14624 g/mol |
| LogP | 3.7883 |
| Topological Polar Surface Area | 140.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 525.14624 |
| Monoisotopic Mass | 525.14624 |
| Heavy Atoms | 36 |
| Complexity | 1332.6356 |
Chemical Identifiers
| CAS Number | 906261-57-2 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)C2=C(N(N=N2)C3=NON=C3N)CSC4=CC=C(C=C4)Cl |
Product Overview
AC1O2I8N (CAS 906261-57-2), with molecular formula C23H24ClN9O2S and molecular weight 525.14624 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]triazole-4-carboxamide.
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