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PDT

Summary
Name:1,3-PROPANEDITHIOL
Formula:C3 H8 S2
Formal charge:0
Formula weight:108.226 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04propane-1,3-dithiol
OpenEye OEToolkits1.5.0propane-1,3-dithiol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04SCCCS
SMILES_CANONICALCACTVS3.341SCCCS
SMILESCACTVS3.341SCCCS
SMILES_CANONICALOpenEye OEToolkits1.5.0C(CS)CS
SMILESOpenEye OEToolkits1.5.0C(CS)CS
InChIInChI1.03InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2
InChIKeyInChI1.03ZJLMKPKYJBQJNH-UHFFFAOYSA-N

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PDB entries from 2024-07-10

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