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HVQ

Summary
Name:thiophen-3-ylmethylazanium
Formula:C5 H8 N S
Formal charge:1
Formula weight:114.189 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.6thiophen-3-ylmethylazanium

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C5H7NS/c6-3-5-1-2-7-4-5/h1-2,4H,3,6H2/p+1
InChIKeyInChI1.03DUDAKCCDHRNMDJ-UHFFFAOYSA-O
SMILES_CANONICALCACTVS3.385[NH3+]Cc1cscc1
SMILESCACTVS3.385[NH3+]Cc1cscc1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cscc1C[NH3+]
SMILESOpenEye OEToolkits2.0.6c1cscc1C[NH3+]

225946

PDB entries from 2024-10-09

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