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I5Z

Summary
Name:6-cyclopropyl-1H-pyrimidine-2,4-dione
Formula:C7 H8 N2 O2
Formal charge:0
Formula weight:152.151 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.76-cyclopropyl-1~{H}-pyrimidine-2,4-dione

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C7H8N2O2/c10-6-3-5(4-1-2-4)8-7(11)9-6/h3-4H,1-2H2,(H2,8,9,10,11)
InChIKeyInChI1.06ABHXYFPEQCXJJJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O=C1NC(=O)C=C(N1)C2CC2
SMILESCACTVS3.385O=C1NC(=O)C=C(N1)C2CC2
SMILES_CANONICALOpenEye OEToolkits2.0.7C1CC1C2=CC(=O)NC(=O)N2
SMILESOpenEye OEToolkits2.0.7C1CC1C2=CC(=O)NC(=O)N2

222415

数据于2024-07-10公开中

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