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X4P

Summary
Name:2-chloropyridine-4-carboxamide
Formula:C6 H5 Cl N2 O
Formal charge:0
Formula weight:156.57 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-chloropyridine-4-carboxamide
OpenEye OEToolkits2.0.72-chloranylpyridine-4-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(N)(c1cc(Cl)ncc1)=O
InChIInChI1.03InChI=1S/C6H5ClN2O/c7-5-3-4(6(8)10)1-2-9-5/h1-3H,(H2,8,10)
InChIKeyInChI1.03DEMJOLRJLACBRX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NC(=O)c1ccnc(Cl)c1
SMILESCACTVS3.385NC(=O)c1ccnc(Cl)c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cnc(cc1C(=O)N)Cl
SMILESOpenEye OEToolkits2.0.7c1cnc(cc1C(=O)N)Cl

217705

PDB entries from 2024-03-27

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