AC1LUNE2
1-[[2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-ethylthiourea
Also Known As: 2-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-ethylhydrazinecarbothioamide|1-[[2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-ethylthiourea|2-(2-((5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)acetyl)-N-ethylhydrazinecarbothioamide|2-[5-(4-chlorophenyl)-4-ethyl(1,2,4-triazol-3-ylthio)]-N-{[(ethylamino)thioxom ethyl]amino}acetamide
| Molecular Formula | C15H19ClN6OS2 |
|---|---|
| Molecular Weight | 398.07504 g/mol |
| LogP | 2.2257 |
| Topological Polar Surface Area | 83.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.07504 |
| Monoisotopic Mass | 398.07504 |
| Heavy Atoms | 25 |
| Complexity | 734.12286 |
Chemical Identifiers
| CAS Number | 489401-65-2 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)CSC1=NN=C(N1CC)C2=CC=C(C=C2)Cl |
Product Overview
AC1LUNE2 (CAS 489401-65-2), with molecular formula C15H19ClN6OS2 and molecular weight 398.07504 g/mol. IUPAC: 1-[[2-[[5-(4-chlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-ethylthiourea.
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