EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H23ClFN3O2 |
| Net Charge | 0 |
| Average Mass | 403.885 |
| Monoisotopic Mass | 403.14628 |
| SMILES | O=C(NC1CCCCC1)C(c1cccnc1)N(C(=O)CCl)c1ccc(F)cc1 |
| InChI | InChI=1S/C21H23ClFN3O2/c22-13-19(27)26(18-10-8-16(23)9-11-18)20(15-5-4-12-24-14-15)21(28)25-17-6-2-1-3-7-17/h4-5,8-12,14,17,20H,1-3,6-7,13H2,(H,25,28) |
| InChIKey | IGCXFVOTAXQEEE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(N-(2-chloro-1-oxoethyl)-4-fluoroanilino)-N-cyclohexyl-2-(3-pyridinyl)acetamide (CHEBI:91665) has functional parent α-amino acid (CHEBI:33704) |
| 2-(N-(2-chloro-1-oxoethyl)-4-fluoroanilino)-N-cyclohexyl-2-(3-pyridinyl)acetamide (CHEBI:91665) is a organonitrogen compound (CHEBI:35352) |
| 2-(N-(2-chloro-1-oxoethyl)-4-fluoroanilino)-N-cyclohexyl-2-(3-pyridinyl)acetamide (CHEBI:91665) is a organooxygen compound (CHEBI:36963) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1501 | LINCS |