AC1NVLXU
2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
Also Known As: (E)-2-((4-oxo-3-(p-tolyl)-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N'-((E)-3-phenylallylidene)acetohydrazide|2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide|N-((1Z,3E)-4-phenyl-1-azabuta-1,3-dienyl)-2-[3-(4-methylphenyl)-4-oxo(3,5,6,7, 8-pentahydrobenzo[b]thiopheno[2,3-d]pyrimidin-2-ylthio)]acetamide
| Molecular Formula | C28H26N4O2S2 |
|---|---|
| Molecular Weight | 514.1497 g/mol |
| LogP | 5.54192 |
| Topological Polar Surface Area | 76.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 514.1497 |
| Monoisotopic Mass | 514.1497 |
| Heavy Atoms | 36 |
| Complexity | 1502.8372 |
Chemical Identifiers
| CAS Number | 613231-76-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N/N=C\C=C\C4=CC=CC=C4)SC5=C3CCCC5 |
Product Overview
AC1NVLXU (CAS 613231-76-8), with molecular formula C28H26N4O2S2 and molecular weight 514.1497 g/mol. IUPAC: 2-[[3-(4-methylphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide.