6MU
Summary
Name: | 6-methylpyrimidine-2,4-diol |
Formula: | C5 H6 N2 O2 |
Formal charge: | 0 |
Formula weight: | 126.113 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 6-methylpyrimidine-2,4-diol |
OpenEye OEToolkits | 1.7.6 | 6-methylpyrimidine-2,4-diol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Oc1nc(O)nc(c1)C |
InChI | InChI | 1.03 | InChI=1S/C5H6N2O2/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9) |
InChIKey | InChI | 1.03 | SHVCSCWHWMSGTE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | Cc1cc(O)nc(O)n1 |
SMILES | CACTVS | 3.370 | Cc1cc(O)nc(O)n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1cc(nc(n1)O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cc(nc(n1)O)O |