A13
Summary
| Name: | 4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-AMINE |
| Formula: | C6 H6 F3 N3 |
| Formal charge: | 0 |
| Formula weight: | 177.127 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-methyl-6-(trifluoromethyl)pyrimidin-2-amine |
| OpenEye OEToolkits | 1.5.0 | 4-methyl-6-(trifluoromethyl)pyrimidin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | FC(F)(F)c1nc(nc(c1)C)N |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1cc(nc(N)n1)C(F)(F)F |
| SMILES | CACTVS | 3.341 | Cc1cc(nc(N)n1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1cc(nc(n1)N)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1cc(nc(n1)N)C(F)(F)F |
| InChI | InChI | 1.03 | InChI=1S/C6H6F3N3/c1-3-2-4(6(7,8)9)12-5(10)11-3/h2H,1H3,(H2,10,11,12) |
| InChIKey | InChI | 1.03 | CNTCLEOUAMWZGS-UHFFFAOYSA-N |
