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WQV

Summary
Name:N-(5-bromo-2-oxo-1,2-dihydropyridin-3-yl)acetamide
Formula:C7 H7 Br N2 O2
Formal charge:0
Formula weight:231.047 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-(5-bromo-2-oxo-1,2-dihydropyridin-3-yl)acetamide
OpenEye OEToolkits2.0.7~{N}-(5-bromanyl-2-oxidanylidene-1~{H}-pyridin-3-yl)ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01N1C(=O)C(NC(=O)C)=CC(=C1)Br
InChIInChI1.03InChI=1S/C7H7BrN2O2/c1-4(11)10-6-2-5(8)3-9-7(6)12/h2-3H,1H3,(H,9,12)(H,10,11)
InChIKeyInChI1.03DZPXAAPHBCJNCQ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=O)NC1=CC(=CNC1=O)Br
SMILESCACTVS3.385CC(=O)NC1=CC(=CNC1=O)Br
SMILES_CANONICALOpenEye OEToolkits2.0.7CC(=O)NC1=CC(=CNC1=O)Br
SMILESOpenEye OEToolkits2.0.7CC(=O)NC1=CC(=CNC1=O)Br

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PDB entries from 2024-04-24

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