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CHEBI:126302 - (1R,5S)-N-(3-chlorophenyl)-7-[4-[3-[dimethylamino(oxo)methyl]phenyl]phenyl]-3,6-diazabicyclo[3.1.1]heptane-6-carboxamide

ChEBI IDCHEBI:126302
ChEBI Name(1R,5S)-N-(3-chlorophenyl)-7-[4-[3-[dimethylamino(oxo)methyl]phenyl]phenyl]-3,6-diazabicyclo[3.1.1]heptane-6-carboxamide
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DownloadsMolfile
FormulaC27H27ClN4O2
Net Charge0
Average Mass474.992
Monoisotopic Mass474.18225
SMILESCN(C)C(=O)c1cccc(-c2ccc(C3[C@H]4CNC[C@@H]3N4C(=O)Nc3cccc(Cl)c3)cc2)c1
InChIInChI=1S/C27H27ClN4O2/c1-31(2)26(33)20-6-3-5-19(13-20)17-9-11-18(12-10-17)25-23-15-29-16-24(25)32(23)27(34)30-22-8-4-7-21(28)14-22/h3-14,23-25,29H,15-16H2,1-2H3,(H,30,34)/t23-,24+,25?
InChIKeyDFCQVAMCMOCMQZ-XMGLRAKGSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,5S)-N-(3-chlorophenyl)-7-[4-[3-[dimethylamino(oxo)methyl]phenyl]phenyl]-3,6-diazabicyclo[3.1.1]heptane-6-carboxamide (CHEBI:126302) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-37868LINCS