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05Y

Summary
Name:~{N}-[1-(2-pyridin-2-ylethyl)benzimidazol-2-yl]propanamide
Formula:C17 H18 N4 O
Formal charge:0
Formula weight:294.351 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-[1-(2-pyridin-2-ylethyl)benzimidazol-2-yl]propanamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H18N4O/c1-2-16(22)20-17-19-14-8-3-4-9-15(14)21(17)12-10-13-7-5-6-11-18-13/h3-9,11H,2,10,12H2,1H3,(H,19,20,22)
InChIKeyInChI1.03XNCNQSNDNANIRM-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCC(=O)Nc1nc2ccccc2n1CCc3ccccn3
SMILESCACTVS3.385CCC(=O)Nc1nc2ccccc2n1CCc3ccccn3
SMILES_CANONICALOpenEye OEToolkits2.0.7CCC(=O)Nc1nc2ccccc2n1CCc3ccccn3
SMILESOpenEye OEToolkits2.0.7CCC(=O)Nc1nc2ccccc2n1CCc3ccccn3

219869

PDB entries from 2024-05-15

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