EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H14N4O2 |
| Net Charge | 0 |
| Average Mass | 258.281 |
| Monoisotopic Mass | 258.11168 |
| SMILES | Cc1ccc2oc(N=C(N)NC(=O)C3CC3)nc2c1 |
| InChI | InChI=1S/C13H14N4O2/c1-7-2-5-10-9(6-7)15-13(19-10)17-12(14)16-11(18)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H3,14,15,16,17,18) |
| InChIKey | KTOQJKLRNXMTNW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[amino-[(5-methyl-1,3-benzoxazol-2-yl)imino]methyl]cyclopropanecarboxamide (CHEBI:105363) is a benzoxazole (CHEBI:46700) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16726 | LINCS |