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 | |
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Formal Charge | 0 |
Atom Count | 20 |
Chiral Atom Count | 0 |
Bond Count | 20 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 5-azanyl-3,6-dimethyl-1H-pyrimidine-2,4-dione |
Systematic Name (OpenEye OEToolkits) | 5-azanyl-3,6-dimethyl-1~{H}-pyrimidine-2,4-dione |
Formula | C6 H9 N3 O2 |
Molecular Weight | 155.155 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CN1C(=O)NC(=C(N)C1=O)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1=C(C(=O)N(C(=O)N1)C)N |
Canonical SMILES | CACTVS | 3.385 | CN1C(=O)NC(=C(N)C1=O)C |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CC1=C(C(=O)N(C(=O)N1)C)N |
InChI | InChI | 1.06 | InChI=1S/C6H9N3O2/c1-3-4(7)5(10)9(2)6(11)8-3/h7H2,1-2H3,(H,8,11) |
InChIKey | InChI | 1.06 | DMYXWQPNMMVHBF-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 57357509 |