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CHEBI:125945 - (1R,5S)-6-(2-methoxyphenyl)sulfonyl-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane

ChEBI IDCHEBI:125945
ChEBI Name(1R,5S)-6-(2-methoxyphenyl)sulfonyl-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane
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FormulaC23H23N3O3S
Net Charge0
Average Mass421.522
Monoisotopic Mass421.14601
SMILESCOc1ccccc1S(=O)(=O)N1[C@@H]2CNC[C@H]1C2c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C23H23N3O3S/c1-29-21-4-2-3-5-22(21)30(27,28)26-19-14-25-15-20(26)23(19)18-8-6-16(7-9-18)17-10-12-24-13-11-17/h2-13,19-20,23,25H,14-15H2,1H3/t19-,20+,23?
InChIKeyMITDCEQWVIFCFM-DETIRCLXSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,5S)-6-(2-methoxyphenyl)sulfonyl-7-(4-pyridin-4-ylphenyl)-3,6-diazabicyclo[3.1.1]heptane (CHEBI:125945) is a piperidines (CHEBI:26151)
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