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QBK

Summary
Name:5-azanyl-[1,3]thiazolo[5,4-d]pyrimidine-2,7-dione
Formula:C5 H2 N4 O2 S
Formal charge:0
Formula weight:182.16 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.75-azanyl-[1,3]thiazolo[5,4-d]pyrimidine-2,7-dione

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C5H2N4O2S/c6-4-8-2(10)1-3(9-4)12-5(11)7-1/h(H2,6,8,10)
InChIKeyInChI1.03AXABAVYDNQCEBU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385NC1=NC(=O)C2=NC(=O)SC2=N1
SMILESCACTVS3.385NC1=NC(=O)C2=NC(=O)SC2=N1
SMILES_CANONICALOpenEye OEToolkits2.0.7C12=NC(=O)SC1=NC(=NC2=O)N
SMILESOpenEye OEToolkits2.0.7C12=NC(=O)SC1=NC(=NC2=O)N

223166

PDB entries from 2024-07-31

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