EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H17N3S |
| Net Charge | 0 |
| Average Mass | 235.356 |
| Monoisotopic Mass | 235.11432 |
| SMILES | CCCn1c(C)cc(-c2csc(N)n2)c1C |
| InChI | InChI=1S/C12H17N3S/c1-4-5-15-8(2)6-10(9(15)3)11-7-16-12(13)14-11/h6-7H,4-5H2,1-3H3,(H2,13,14) |
| InChIKey | ANNYAOZIWXFBSS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-thiazolamine (CHEBI:104039) is a thiazoles (CHEBI:48901) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15397 | LINCS |