AC1MWHIE
propan-2-yl 2-[[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: Propan-2-yl 2-[[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate|isopropyl 2-((5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetate|methylethyl 2-[4-(4-methoxyphenyl)-5-(3-methoxyphenyl)-1,2,4-triazol-3-ylthio] acetate|propan-2-yl {[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate|propan-2-yl 2-{[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
| Molecular Formula | C21H23N3O4S |
|---|---|
| Molecular Weight | 413.14093 g/mol |
| LogP | 3.9952 |
| Topological Polar Surface Area | 75.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 413.14093 |
| Monoisotopic Mass | 413.14093 |
| Heavy Atoms | 29 |
| Complexity | 970.3125 |
Chemical Identifiers
| CAS Number | 862116-40-3 |
|---|---|
| SMILES | CC(C)OC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)OC)C3=CC(=CC=C3)OC |
Product Overview
AC1MWHIE (CAS 862116-40-3), with molecular formula C21H23N3O4S and molecular weight 413.14093 g/mol. IUPAC: propan-2-yl 2-[[5-(3-methoxyphenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate.
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