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TQK

Summary
Name:2-methyl-4-(2-phenylimidazol-1-yl)benzaldehyde
Formula:C17 H14 N2 O
Formal charge:0
Formula weight:262.306 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72-methyl-4-(2-phenylimidazol-1-yl)benzaldehyde

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H14N2O/c1-13-11-16(8-7-15(13)12-20)19-10-9-18-17(19)14-5-3-2-4-6-14/h2-12H,1H3
InChIKeyInChI1.03JLZNBKMFWOJNBX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1cc(ccc1C=O)n2ccnc2c3ccccc3
SMILESCACTVS3.385Cc1cc(ccc1C=O)n2ccnc2c3ccccc3
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cc(ccc1C=O)n2ccnc2c3ccccc3
SMILESOpenEye OEToolkits2.0.7Cc1cc(ccc1C=O)n2ccnc2c3ccccc3

222415

PDB entries from 2024-07-10

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