AC1M1ZLZ
methyl 2-[[4-(2-methoxyphenyl)-5-[[(3-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: SR-01000123044-1|F0601-0100|methyl 2-[[4-(2-methoxyphenyl)-5-[[(3-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate|methyl 2-{[4-(2-methoxyphenyl)-5-{[(3-methylphenyl)formamido]methyl}-4H-1,2,4-triazol-3-yl]sulfanyl}acetate|methyl [(4-(2-methoxyphenyl)-5-{[(3-methylbenzoyl)amino]methyl}-4H-1,2,4-triazol-3-yl)thio]acetate|2-[[4-(2-methoxyphenyl)-5-[(m-toluoylamino)methyl]-1,2,4-triazol-3-yl]thio]acetic acid methyl ester|2-[[4-(2-methoxyphenyl)-5-[[[(3-methylphenyl)-oxomethyl]amino]methyl]-1,2,4-triazol-3-yl]thio]acetic acid methyl ester|methyl 2-((4-(2-methoxyphenyl)-5-((3-methylbenzamido)methyl)-4H-1,2,4-triazol-3-yl)thio)acetate|methyl 2-[[4-(2-methoxyphenyl)-5-[[(3-methylphenyl)carbonylamino]methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanoate
| Molecular Formula | C21H22N4O4S |
|---|---|
| Molecular Weight | 426.13617 g/mol |
| LogP | 2.77942 |
| Topological Polar Surface Area | 95.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.13617 |
| Monoisotopic Mass | 426.13617 |
| Heavy Atoms | 30 |
| Complexity | 1050.9906 |
Chemical Identifiers
| CAS Number | 689751-37-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3OC)SCC(=O)OC |
Product Overview
AC1M1ZLZ (CAS 689751-37-9), with molecular formula C21H22N4O4S and molecular weight 426.13617 g/mol. IUPAC: methyl 2-[[4-(2-methoxyphenyl)-5-[[(3-methylbenzoyl)amino]methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate.