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OH7

Summary
Name:N-{4-[4-(hydroxymethyl)-1H-imidazol-2-yl]butyl}acetamide
Formula:C10 H17 N3 O2
Formal charge:0
Formula weight:211.261 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-{4-[4-(hydroxymethyl)-1H-imidazol-2-yl]butyl}acetamide
OpenEye OEToolkits2.0.7~{N}-[4-[4-(hydroxymethyl)-1~{H}-imidazol-2-yl]butyl]ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(NC(C)=O)CCCc1ncc(CO)n1
InChIInChI1.03InChI=1S/C10H17N3O2/c1-8(15)11-5-3-2-4-10-12-6-9(7-14)13-10/h6,14H,2-5,7H2,1H3,(H,11,15)(H,12,13)
InChIKeyInChI1.03RGIIKOKBGRWBCV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=O)NCCCCc1[nH]cc(CO)n1
SMILESCACTVS3.385CC(=O)NCCCCc1[nH]cc(CO)n1
SMILES_CANONICALOpenEye OEToolkits2.0.7CC(=O)NCCCCc1[nH]cc(n1)CO
SMILESOpenEye OEToolkits2.0.7CC(=O)NCCCCc1[nH]cc(n1)CO

217705

PDB entries from 2024-03-27

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