AC1NA7I8
2,5-dichloro-N-[[4-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: Oprea1_127097|F0475-0158|2,5-dichloro-N-((5-thioxo-4-(m-tolyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)benzamide|2,5-dichloro-N-{[4-(3-methylphenyl)-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl]methyl}benzamide|2,5-dichloro-N-[[4-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide
CAS: 391887-03-9
| Molecular Formula | C17H14Cl2N4OS |
|---|---|
| Molecular Weight | 392.02655 g/mol |
| LogP | 4.47511 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.02655 |
| Monoisotopic Mass | 392.02655 |
| Heavy Atoms | 25 |
| Complexity | 996.3081 |
Chemical Identifiers
| CAS Number | 391887-03-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=NNC2=S)CNC(=O)C3=C(C=CC(=C3)Cl)Cl |
Product Overview
AC1NA7I8 (CAS 391887-03-9), with molecular formula C17H14Cl2N4OS and molecular weight 392.02655 g/mol. IUPAC: 2,5-dichloro-N-[[4-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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