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
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 4-oxidanyl-3,4-dihydro-1~{H}-pyrimidin-2-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-3,7H,(H2,5,6,8) |
InChIKey | InChI | 1.06 | DEAAWXYGBWCVJW-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O[C@H]1NC(=O)NC=C1 |
SMILES | CACTVS | 3.385 | O[CH]1NC(=O)NC=C1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1=CNC(=O)NC1O |
SMILES | OpenEye OEToolkits | 2.0.7 | C1=CNC(=O)NC1O |