Cambridge id 6644173
4,5-dimethyl-12-(2-methylprop-2-enylsulfanyl)-8-phenyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one
Also Known As: AJ-292/14559258|SR-01000501890-1|2,3-dimethyl-8-((2-methylallyl)thio)-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one|2,3-dimethyl-8-[(2-methyl-2-propenyl)sulfanyl]-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one|4,5-dimethyl-12-(2-methylprop-2-enylsulfanyl)-8-phenyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one|6,7-dimethyl-1-(2-methylprop-2-enylthio)-4-phenyl-4,9-dihydrothiopheno[3,2-e]1 ,2,4-triazolo[4,3-a]pyrimidin-5-one
| Molecular Formula | C19H18N4OS2 |
|---|---|
| Molecular Weight | 382.0922 g/mol |
| LogP | 4.37994 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.0922 |
| Monoisotopic Mass | 382.0922 |
| Heavy Atoms | 26 |
| Complexity | 1201.4515 |
Chemical Identifiers
| CAS Number | 430471-89-9 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C3=NN=C(N23)SCC(=C)C)C4=CC=CC=C4)C |
Product Overview
Cambridge id 6644173 (CAS 430471-89-9), with molecular formula C19H18N4OS2 and molecular weight 382.0922 g/mol. IUPAC: 4,5-dimethyl-12-(2-methylprop-2-enylsulfanyl)-8-phenyl-3-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),4,9,11-tetraen-7-one.
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