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5YH

Summary
Name:1-[(2R)-3-[3,6-bis(fluoranyl)carbazol-9-yl]-2-oxidanyl-propyl]imidazolidin-2-one
Formula:C18 H17 F2 N3 O2
Formal charge:0
Formula weight:345.343 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71-[(2~{R})-3-[3,6-bis(fluoranyl)carbazol-9-yl]-2-oxidanyl-propyl]imidazolidin-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C18H17F2N3O2/c19-11-1-3-16-14(7-11)15-8-12(20)2-4-17(15)23(16)10-13(24)9-22-6-5-21-18(22)25/h1-4,7-8,13,24H,5-6,9-10H2,(H,21,25)/t13-/m0/s1
InChIKeyInChI1.03MUVYYQQLOKRDQS-ZDUSSCGKSA-N
SMILES_CANONICALCACTVS3.385O[C@@H](CN1CCNC1=O)Cn2c3ccc(F)cc3c4cc(F)ccc24
SMILESCACTVS3.385O[CH](CN1CCNC1=O)Cn2c3ccc(F)cc3c4cc(F)ccc24
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc2c(cc1F)c3cc(ccc3n2C[C@H](CN4CCNC4=O)O)F
SMILESOpenEye OEToolkits2.0.7c1cc2c(cc1F)c3cc(ccc3n2CC(CN4CCNC4=O)O)F

221051

PDB entries from 2024-06-12

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