Stk855913
2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-prop-2-enylacetamide
Also Known As: CBMicro_039000|BAS 02072546|BIM-0039032.P001|AB00667955-01|AF-399/13479031|SR-01000441975-1|N-allyl-2-((4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide|F0464-0013|2-({3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide|2-(4-oxo(3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d]pyrimidin-2-ylthio))-N-pr op-2-enylacetamide|2-[(4-hydroxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(prop-2-en-1-yl)acetamide|2-[(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(prop-2-en-1-yl)acetamide|2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-prop-2-enylacetamide|N-allyl-2-[(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide|N-allyl-2-[(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)thio]acetamide
| Molecular Formula | C15H17N3O2S2 |
|---|---|
| Molecular Weight | 335.07623 g/mol |
| LogP | 2.2577 |
| Topological Polar Surface Area | 74.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 335.07623 |
| Monoisotopic Mass | 335.07623 |
| Heavy Atoms | 22 |
| Complexity | 778.9209 |
Chemical Identifiers
| CAS Number | 5965-97-9 |
|---|---|
| SMILES | C=CCNC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1 |
Product Overview
Stk855913 (CAS 5965-97-9), with molecular formula C15H17N3O2S2 and molecular weight 335.07623 g/mol. IUPAC: 2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-prop-2-enylacetamide.
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