| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:53:12 UTC |
|---|
| Update Date | 2025-03-25 00:51:15 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02185782 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H8F3N5S |
|---|
| Molecular Mass | 263.0453 |
|---|
| SMILES | Nc1nc(SCCC(F)(F)F)nc2nccn12 |
|---|
| InChI Key | PLIQIYHGDAJPJP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | triazines |
|---|
| Subclass | 1,3,5-triazines |
|---|
| Direct Parent | alkyl-2-thio-s-triazines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | alkyl fluoridesalkylarylthioethersaminotriazinesazacyclic compoundshalo-s-triazinesheteroaromatic compoundshydrocarbon derivativesimidazolesn-substituted imidazolesorganofluoridesorganopnictogen compoundsprimary aminessulfenyl compounds |
|---|
| Substituents | amino-1,3,5-triazinealkylarylthioetherorganosulfur compoundorganohalogen compoundaryl thioetheraromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundalkyl halideazolen-substituted imidazolesulfenyl compoundazacyclealkyl fluorideorganofluorideaminotriazineheteroaromatic compoundthioetherhalo-s-triazinehydrocarbon derivativeprimary amineorganic nitrogen compoundalkyl-2-thio-s-triazineamine |
|---|
