AC1LJVTE
methyl 4-[[2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: methyl 4-[({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate|methyl 4-(2-((5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|methyl 4-{2-[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-ylthio]acetylamino}be nzoate|methyl 4-(2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzoate|methyl 4-[[2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C24H19ClN4O3S |
|---|---|
| Molecular Weight | 478.08664 g/mol |
| LogP | 5.1051 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 478.08664 |
| Monoisotopic Mass | 478.08664 |
| Heavy Atoms | 33 |
| Complexity | 1276.6312 |
Chemical Identifiers
| CAS Number | 397290-91-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4Cl |
Product Overview
AC1LJVTE (CAS 397290-91-4), with molecular formula C24H19ClN4O3S and molecular weight 478.08664 g/mol. IUPAC: methyl 4-[[2-[[5-(2-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
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