AC1M6TL0
4-(3-methylphenyl)-5-sulfanylidene-8,10-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one
Also Known As: 4-(3-Methylphenyl)-5-sulfanyl-8,10-dithia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-3-one|2-mercapto-3-(3-methylphenyl)-6,7-dihydro-5H-thiopyrano[3',2':4,5]thieno[2,3-d]pyrimidin-4(3H)-one|4-(3-methylphenyl)-5-sulfanyl-8,10-dithia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one|4-(3-methylphenyl)-5-sulfanylidene-8,10-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one|4-(3-methylphenyl)-5-sulfanyl-8,10-dithia-4,6-diazatricyclo[7.4.0.02,?]trideca-1(9),2(7),5-trien-3-one
| Molecular Formula | C16H14N2OS3 |
|---|---|
| Molecular Weight | 346.02682 g/mol |
| LogP | 4.45651 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.02682 |
| Monoisotopic Mass | 346.02682 |
| Heavy Atoms | 22 |
| Complexity | 996.77405 |
Chemical Identifiers
| CAS Number | 796067-52-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C(NC2=S)SC4=C3CCCS4 |
Product Overview
AC1M6TL0 (CAS 796067-52-2), with molecular formula C16H14N2OS3 and molecular weight 346.02682 g/mol. IUPAC: 4-(3-methylphenyl)-5-sulfanylidene-8,10-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-3-one.
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