AC1LD8YJ
N-(5-acetamido-2-methoxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: N-[5-(ACETYLAMINO)-2-METHOXYPHENYL]-2-{[4-ALLYL-5-(2-PYRIDINYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE|N-(5-Acetamido-2-methoxyphenyl)-2-((4-allyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide|637-448-7|N-(5-(Acetylamino)-2-methoxyphenyl)-2-((4-allyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-YL)sulfanyl)acetamide|N-(5-acetamido-2-methoxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide|N-(5-acetamido-2-methoxyphenyl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-[5-(acetylamino)-2-methoxyphenyl]-2-(4-prop-2-enyl-5-(2-pyridyl)(1,2,4-triaz ol-3-ylthio))acetamide|N-[5-(acetylamino)-2-methoxyphenyl]-2-{[4-(prop-2-en-1-yl)-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C21H22N6O3S |
|---|---|
| Molecular Weight | 438.1474 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 438.1474 |
| Monoisotopic Mass | 438.1474 |
| Heavy Atoms | 31 |
| Complexity | 624.0 |
Chemical Identifiers
| CAS Number | 577789-17-4 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CC=N3 |
| InChIKey | RCZGJPUOHRPJKM-UHFFFAOYSA-N |
Product Overview
AC1LD8YJ (CAS 577789-17-4), with molecular formula C21H22N6O3S and molecular weight 438.1474 g/mol. IUPAC: N-(5-acetamido-2-methoxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
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