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OS0

Summary
Name:4-oxidanyl-3,4-dihydro-1H-pyrimidin-2-one
Formula:C4 H6 N2 O2
Formal charge:0
Formula weight:114.103 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.74-oxidanyl-3,4-dihydro-1~{H}-pyrimidin-2-one

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-3,7H,(H2,5,6,8)
InChIKeyInChI1.06DEAAWXYGBWCVJW-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O[C@H]1NC(=O)NC=C1
SMILESCACTVS3.385O[CH]1NC(=O)NC=C1
SMILES_CANONICALOpenEye OEToolkits2.0.7C1=CNC(=O)NC1O
SMILESOpenEye OEToolkits2.0.7C1=CNC(=O)NC1O

222415

PDB entries from 2024-07-10

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