EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H30ClF3N4O2 |
| Net Charge | 0 |
| Average Mass | 535.010 |
| Monoisotopic Mass | 534.20094 |
| SMILES | CC1(C(=O)NCCCNc2ncc(C(F)(F)F)cc2Cl)C=CC2(CCCCC2)N1C(=O)c1ccccc1 |
| InChI | InChI=1S/C27H30ClF3N4O2/c1-25(24(37)33-16-8-15-32-22-21(28)17-20(18-34-22)27(29,30)31)13-14-26(11-6-3-7-12-26)35(25)23(36)19-9-4-2-5-10-19/h2,4-5,9-10,13-14,17-18H,3,6-8,11-12,15-16H2,1H3,(H,32,34)(H,33,37) |
| InChIKey | XDRZVQDEWUNICW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-benzoyl-N-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]propyl]-2-methyl-1-azaspiro[4.5]dec-3-ene-2-carboxamide (CHEBI:109719) has functional parent α-amino acid (CHEBI:33704) |
| 1-benzoyl-N-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]propyl]-2-methyl-1-azaspiro[4.5]dec-3-ene-2-carboxamide (CHEBI:109719) is a organonitrogen compound (CHEBI:35352) |
| 1-benzoyl-N-[3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]propyl]-2-methyl-1-azaspiro[4.5]dec-3-ene-2-carboxamide (CHEBI:109719) is a organooxygen compound (CHEBI:36963) |
| Manual Xrefs | Databases |
|---|---|
| LSM-21147 | LINCS |