AC1OAM5S
[2-methoxy-4-[(E)-[3-(3-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenyl] acetate
Also Known As: (E)-4-(((3-mercapto-5-(3-methoxyphenyl)-4H-1,2,4-triazol-4-yl)imino)methyl)-2-methoxyphenyl acetate|[2-methoxy-4-[(E)-[3-(3-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenyl] acetate|2-methoxy-4-((E)-{[3-(3-methoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenyl acetate|2-methoxy-4-[(E)-{[3-(3-methoxyphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenyl acetate|4-{(1E)-2-[5-(3-methoxyphenyl)-3-sulfanyl(1,2,4-triazol-4-yl)]-2-azavinyl}-2-m ethoxyphenyl acetate
| Molecular Formula | C19H18N4O4S |
|---|---|
| Molecular Weight | 398.1049 g/mol |
| LogP | 3.43239 |
| Topological Polar Surface Area | 90.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.1049 |
| Monoisotopic Mass | 398.1049 |
| Heavy Atoms | 28 |
| Complexity | 1087.5328 |
Chemical Identifiers
| CAS Number | 613249-19-7 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1)/C=N/N2C(=NNC2=S)C3=CC(=CC=C3)OC)OC |
Product Overview
AC1OAM5S (CAS 613249-19-7), with molecular formula C19H18N4O4S and molecular weight 398.1049 g/mol. IUPAC: [2-methoxy-4-[(E)-[3-(3-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenyl] acetate.