FIQ
Summary
Name: | 6-cyclopropyl-3-methyl-1H-pyrimidine-2,4-dione |
Formula: | C8 H10 N2 O2 |
Formal charge: | 0 |
Formula weight: | 166.177 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 6-cyclopropyl-3-methyl-1~{H}-pyrimidine-2,4-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C8H10N2O2/c1-10-7(11)4-6(5-2-3-5)9-8(10)12/h4-5H,2-3H2,1H3,(H,9,12) |
InChIKey | InChI | 1.06 | SJCKLNPJUZKFGN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN1C(=O)NC(=CC1=O)C2CC2 |
SMILES | CACTVS | 3.385 | CN1C(=O)NC(=CC1=O)C2CC2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN1C(=O)C=C(NC1=O)C2CC2 |
SMILES | OpenEye OEToolkits | 2.0.7 | CN1C(=O)C=C(NC1=O)C2CC2 |