AC1LZINZ
2-[(3-methylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: 2-[(3-methylbenzyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one|2-[(3-methylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one|2-[(3-methylphenyl)methylthio]-3-prop-2-enyl-3,5,6,7,8-pentahydrobenzo[b]thiop heno[2,3-d]pyrimidin-4-one|3-allyl-2-((3-methylbenzyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one|5-{[(3-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one
| Molecular Formula | C21H22N2OS2 |
|---|---|
| Molecular Weight | 382.11737 g/mol |
| LogP | 5.12352 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.11737 |
| Monoisotopic Mass | 382.11737 |
| Heavy Atoms | 26 |
| Complexity | 1032.4025 |
Chemical Identifiers
| CAS Number | 577984-67-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC=C |
Product Overview
AC1LZINZ (CAS 577984-67-9), with molecular formula C21H22N2OS2 and molecular weight 382.11737 g/mol. IUPAC: 2-[(3-methylphenyl)methylsulfanyl]-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.