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BGK

Summary
Name:4-([1,3]thiazolo[4,5-b]pyridin-2-yloxy)benzaldehyde
Formula:C13 H8 N2 O2 S
Formal charge:0
Formula weight:256.28 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-([1,3]thiazolo[4,5-b]pyridin-2-yloxy)benzaldehyde

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C13H8N2O2S/c16-8-9-3-5-10(6-4-9)17-13-15-12-11(18-13)2-1-7-14-12/h1-8H
InChIKeyInChI1.03MIXDMADWNWRCQX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O=Cc1ccc(Oc2sc3cccnc3n2)cc1
SMILESCACTVS3.385O=Cc1ccc(Oc2sc3cccnc3n2)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc2c(nc1)nc(s2)Oc3ccc(cc3)C=O
SMILESOpenEye OEToolkits2.0.6c1cc2c(nc1)nc(s2)Oc3ccc(cc3)C=O

218196

PDB entries from 2024-04-10

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