EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H21N5O2S |
| Net Charge | 0 |
| Average Mass | 407.499 |
| Monoisotopic Mass | 407.14160 |
| SMILES | Cc1ccc2nc(SCC(=O)Nc3c(C)n(C)n(-c4ccccc4)c3=O)nc2c1 |
| InChI | InChI=1S/C21H21N5O2S/c1-13-9-10-16-17(11-13)23-21(22-16)29-12-18(27)24-19-14(2)25(3)26(20(19)28)15-7-5-4-6-8-15/h4-11H,12H2,1-3H3,(H,22,23)(H,24,27) |
| InChIKey | GANKKCSDAXWCPT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide (CHEBI:121479) is a pyrazoles (CHEBI:26410) |
| N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide (CHEBI:121479) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32922 | LINCS |