CHEBI:125014 - (1S,5R)-7-[4-(2-fluorophenyl)phenyl]-3-(3-methoxyphenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptane

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ChEBI Name (1S,5R)-7-[4-(2-fluorophenyl)phenyl]-3-(3-methoxyphenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptane
ChEBI ID CHEBI:125014
Stars This entity has been manually annotated by a third party.
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Formula C24H23FN2O3S
Net Charge 0
Average Mass 438.516
Monoisotopic Mass 438.14134
InChI InChI=1S/C24H23FN2O3S/c1-30-18-5-4-6-19(13-18)31(28,29)27-14-22-24(23(15-27)26-22)17-11-9-16(10-12-17)20-7-2-3-8-21(20)25/h2-13,22-24,26H,14-15H2,1H3/t22-,23+,24?
InChIKey ZPUUYYXRCIZCGY-VSGJHWFKSA-N
SMILES COC1=CC(=CC=C1)S(=O)(=O)N2C[C@@H]3C([C@H](C2)N3)C4=CC=C(C=C4)C5=CC=CC=C5F
ChEBI Ontology
Outgoing (1S,5R)-7-[4-(2-fluorophenyl)phenyl]-3-(3-methoxyphenyl)sulfonyl-3,6-diazabicyclo[3.1.1]heptane (CHEBI:125014) is a piperidines (CHEBI:26151)
Manual Xref Database
LSM-36476 LINCS
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