IGT

5-azanyl-3,6-dimethyl-1H-pyrimidine-2,4-dione

Created: 2022-03-21
Last modified:  2022-08-22

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Chemical Details

Formal Charge0
Atom Count20
Chiral Atom Count0
Bond Count20
Aromatic Bond Count0
2D diagram of IGT

Chemical Component Summary

Name5-azanyl-3,6-dimethyl-1H-pyrimidine-2,4-dione
Systematic Name (OpenEye OEToolkits)5-azanyl-3,6-dimethyl-1~{H}-pyrimidine-2,4-dione
FormulaC6 H9 N3 O2
Molecular Weight155.155
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385CN1C(=O)NC(=C(N)C1=O)C
SMILESOpenEye OEToolkits2.0.7CC1=C(C(=O)N(C(=O)N1)C)N
Canonical SMILESCACTVS3.385 CN1C(=O)NC(=C(N)C1=O)C
Canonical SMILESOpenEye OEToolkits2.0.7 CC1=C(C(=O)N(C(=O)N1)C)N
InChIInChI1.06 InChI=1S/C6H9N3O2/c1-3-4(7)5(10)9(2)6(11)8-3/h7H2,1-2H3,(H,8,11)
InChIKeyInChI1.06 DMYXWQPNMMVHBF-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 57357509