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96X

Summary
Name:N-{8-hydroxy-4-[(1H-imidazol-1-yl)methyl]quinolin-2-yl}acetamide
Formula:C15 H14 N4 O2
Formal charge:0
Formula weight:282.297 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-{8-hydroxy-4-[(1H-imidazol-1-yl)methyl]quinolin-2-yl}acetamide
OpenEye OEToolkits2.0.6~{N}-[4-(imidazol-1-ylmethyl)-8-oxidanyl-quinolin-2-yl]ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1ccc(c2c1c(cc(n2)NC(=O)C)Cn3cncc3)O
InChIInChI1.03InChI=1S/C15H14N4O2/c1-10(20)17-14-7-11(8-19-6-5-16-9-19)12-3-2-4-13(21)15(12)18-14/h2-7,9,21H,8H2,1H3,(H,17,18,20)
InChIKeyInChI1.03IZQWAALUGBLUAZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=O)Nc1cc(Cn2ccnc2)c3cccc(O)c3n1
SMILESCACTVS3.385CC(=O)Nc1cc(Cn2ccnc2)c3cccc(O)c3n1
SMILES_CANONICALOpenEye OEToolkits2.0.6CC(=O)Nc1cc(c2cccc(c2n1)O)Cn3ccnc3
SMILESOpenEye OEToolkits2.0.6CC(=O)Nc1cc(c2cccc(c2n1)O)Cn3ccnc3

217157

PDB entries from 2024-03-13

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