EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H14N6O3 |
| Net Charge | 0 |
| Average Mass | 362.349 |
| Monoisotopic Mass | 362.11274 |
| SMILES | Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(-c2nc3ccccc3n2)cc1 |
| InChI | InChI=1S/C18H14N6O3/c1-23-16(15(10-19-23)24(26)27)18(25)20-12-8-6-11(7-9-12)17-21-13-4-2-3-5-14(13)22-17/h2-10H,1H3,(H,20,25)(H,21,22) |
| InChIKey | VMHHZDBQXJXGAX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[4-(1H-benzimidazol-2-yl)phenyl]-2-methyl-4-nitro-3-pyrazolecarboxamide (CHEBI:116258) is a benzimidazoles (CHEBI:22715) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27713 | LINCS |