AC1O4NP7
2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-(4-nitrophenyl)ethylideneamino]acetamide
Also Known As: BAS 01810851|(Z)-2-((4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide|2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-(4-nitrophenyl)ethylideneamino]acetamide|2-{[4-ETHYL-5-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}-N'-[(1Z)-1-(4-NITROPHENYL)ETHYLIDENE]ACETOHYDRAZIDE|N-[(1Z)-2-(4-nitrophenyl)-1-azaprop-1-enyl]-2-[4-ethyl-5-(4-methoxyphenyl)(1,2 ,4-triazol-3-ylthio)]acetamide
| Molecular Formula | C21H22N6O4S |
|---|---|
| Molecular Weight | 454.14233 g/mol |
| LogP | 3.5143 |
| Topological Polar Surface Area | 124.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 454.14233 |
| Monoisotopic Mass | 454.14233 |
| Heavy Atoms | 32 |
| Complexity | 1126.1965 |
Chemical Identifiers
| CAS Number | 303102-91-2 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)N/N=C(/C)\C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC |
Product Overview
AC1O4NP7 (CAS 303102-91-2), with molecular formula C21H22N6O4S and molecular weight 454.14233 g/mol. IUPAC: 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(Z)-1-(4-nitrophenyl)ethylideneamino]acetamide.
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