5-(3-Methyl-1,3-benzothiazol-2-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: SR-01000416746-1|F0163-0015|5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione|5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione|5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|5-(3-methylbenzo[d]thiazol-2(3H)-ylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|5-(3-METHYL-2,3-DIHYDRO-1,3-BENZOTHIAZOL-2-YLIDENE)-2-SULFANYLIDENE-1,3-DIAZINANE-4,6-DIONE
| Molecular Formula | C12H9N3O2S2 |
|---|---|
| Molecular Weight | 291.0136 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 291.0136 |
| Monoisotopic Mass | 291.0136 |
| Heavy Atoms | 19 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 301331-25-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2SC1=C3C(=O)NC(=S)NC3=O |
| InChIKey | HSUUCAGJQUTVTB-UHFFFAOYSA-N |
Product Overview
5-(3-Methyl-1,3-benzothiazol-2-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione (CAS 301331-25-9), with molecular formula C12H9N3O2S2 and molecular weight 291.0136 g/mol. IUPAC: 5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione.