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T0Y

Summary
Name:1-[(thiophen-3-yl)methyl]piperidin-4-ol
Formula:C10 H15 N O S
Formal charge:0
Formula weight:197.297 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.011-[(thiophen-3-yl)methyl]piperidin-4-ol
OpenEye OEToolkits2.0.71-(thiophen-3-ylmethyl)piperidin-4-ol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C1CN(CCC1O)Cc2cscc2
InChIInChI1.03InChI=1S/C10H15NOS/c12-10-1-4-11(5-2-10)7-9-3-6-13-8-9/h3,6,8,10,12H,1-2,4-5,7H2
InChIKeyInChI1.03JQJVNJKLFUBEBG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC1CCN(CC1)Cc2cscc2
SMILESCACTVS3.385OC1CCN(CC1)Cc2cscc2
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cscc1CN2CCC(CC2)O
SMILESOpenEye OEToolkits2.0.7c1cscc1CN2CCC(CC2)O

227111

數據於2024-11-06公開中

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