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A1BKU

Summary
Name:4-methyl-N-{2-[(2-methylprop-2-en-1-yl)oxy]phenyl}-1H-imidazole-5-carboxamide
Formula:C15 H17 N3 O2
Formal charge:0
Formula weight:271.314 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.524-methyl-N-{2-[(2-methylprop-2-en-1-yl)oxy]phenyl}-1H-imidazole-5-carboxamide
OpenEye OEToolkits3.1.0.04-methyl-~{N}-[2-(2-methylprop-2-enoxy)phenyl]-1~{H}-imidazole-5-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52O=C(Nc1ccccc1OCC(=C)C)c1[NH]cnc1C
InChIInChI1.06InChI=1S/C15H17N3O2/c1-10(2)8-20-13-7-5-4-6-12(13)18-15(19)14-11(3)16-9-17-14/h4-7,9H,1,8H2,2-3H3,(H,16,17)(H,18,19)
InChIKeyInChI1.06SIXBZVSYBVYTRI-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=C)COc1ccccc1NC(=O)c2[nH]cnc2C
SMILESCACTVS3.385CC(=C)COc1ccccc1NC(=O)c2[nH]cnc2C
SMILES_CANONICALOpenEye OEToolkits3.1.0.0Cc1c([nH]cn1)C(=O)Nc2ccccc2OCC(=C)C
SMILESOpenEye OEToolkits3.1.0.0Cc1c([nH]cn1)C(=O)Nc2ccccc2OCC(=C)C

248335

PDB entries from 2026-01-28

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