AC1M19YQ
ethyl 2-[[2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]acetate
Also Known As: ethyl 2-(2-((4-allyl-5-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)acetate|ethyl 2-{2-[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-ylthio]acetylamin o}acetate|ethyl 2-(2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)acetate|ethyl 2-[[2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]acetate|ethyl N-({[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)glycinate
| Molecular Formula | C17H19ClN4O3S |
|---|---|
| Molecular Weight | 394.08664 g/mol |
| LogP | 2.5559 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 394.08664 |
| Monoisotopic Mass | 394.08664 |
| Heavy Atoms | 26 |
| Complexity | 794.06525 |
Chemical Identifiers
| CAS Number | 862129-54-2 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)C2=CC(=CC=C2)Cl |
Product Overview
AC1M19YQ (CAS 862129-54-2), with molecular formula C17H19ClN4O3S and molecular weight 394.08664 g/mol. IUPAC: ethyl 2-[[2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]acetate.