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T6R

Summary
Name:1-ethyl-1H-benzimidazole
Formula:C9 H10 N2
Formal charge:0
Formula weight:146.189 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-ethyl-1H-benzimidazole
OpenEye OEToolkits2.0.71-ethylbenzimidazole

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01CCn1cnc2ccccc21
InChIInChI1.06InChI=1S/C9H10N2/c1-2-11-7-10-8-5-3-4-6-9(8)11/h3-7H,2H2,1H3
InChIKeyInChI1.06WVNMLOGVAVGQIT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCn1cnc2ccccc12
SMILESCACTVS3.385CCn1cnc2ccccc12
SMILES_CANONICALOpenEye OEToolkits2.0.7CCn1cnc2c1cccc2
SMILESOpenEye OEToolkits2.0.7CCn1cnc2c1cccc2

222415

PDB entries from 2024-07-10

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