AC1LQ5XS
N-[[5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide
Also Known As: SR-01000268618-1|N-[[5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide|N-{[5-({2-[(2-ethyl-6-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}benzamide
CAS: 713095-63-7
| Molecular Formula | C22H25N5O2S |
|---|---|
| Molecular Weight | 423.17288 g/mol |
| LogP | 3.34672 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.17288 |
| Monoisotopic Mass | 423.17288 |
| Heavy Atoms | 30 |
| Complexity | 1033.2621 |
Chemical Identifiers
| CAS Number | 713095-63-7 |
|---|---|
| SMILES | CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2C)CNC(=O)C3=CC=CC=C3)C |
Product Overview
AC1LQ5XS (CAS 713095-63-7), with molecular formula C22H25N5O2S and molecular weight 423.17288 g/mol. IUPAC: N-[[5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-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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