EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C17H20Cl2N4OS |
| Net Charge | 0 |
| Average Mass | 399.347 |
| Monoisotopic Mass | 398.07349 |
| SMILES | CCCN1CNc2c(c(=O)nc(=S)n2CCc2cccc(Cl)c2Cl)C1 |
| InChI | InChI=1S/C17H20Cl2N4OS/c1-2-7-22-9-12-15(20-10-22)23(17(25)21-16(12)24)8-6-11-4-3-5-13(18)14(11)19/h3-5,20H,2,6-10H2,1H3,(H,21,24,25) |
| InChIKey | DXDDWXHNWRDUCF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[2-(2,3-dichlorophenyl)ethyl]-6-propyl-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one (CHEBI:93209) is a dichlorobenzene (CHEBI:23697) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3541 | LINCS |