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CHEBI:125083 - 4-[4-[(1S,5R)-3-(3-methoxyphenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide

ChEBI IDCHEBI:125083
ChEBI Name4-[4-[(1S,5R)-3-(3-methoxyphenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide
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DownloadsMolfile
FormulaC27H29N3O4S
Net Charge0
Average Mass491.613
Monoisotopic Mass491.18788
SMILESCOc1cccc(S(=O)(=O)N2C[C@@H]3N[C@H](C2)C3c2ccc(-c3ccc(C(=O)N(C)C)cc3)cc2)c1
InChIInChI=1S/C27H29N3O4S/c1-29(2)27(31)21-13-9-19(10-14-21)18-7-11-20(12-8-18)26-24-16-30(17-25(26)28-24)35(32,33)23-6-4-5-22(15-23)34-3/h4-15,24-26,28H,16-17H2,1-3H3/t24-,25+,26?
InChIKeyNLKGQMJFSSLYIS-IQCGEYIDSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[4-[(1S,5R)-3-(3-methoxyphenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptan-7-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:125083) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-36545LINCS