WOE
Summary
| Name: | 4-CHLORO-6-(2-METHOXYPHENYL)PYRIMIDIN-2-AMINE |
| Formula: | C11 H10 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 235.67 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-chloro-6-(2-methoxyphenyl)pyrimidin-2-amine |
| OpenEye OEToolkits | 1.6.1 | 4-chloro-6-(2-methoxyphenyl)pyrimidin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Clc2nc(nc(c1c(OC)cccc1)c2)N |
| SMILES_CANONICAL | CACTVS | 3.352 | COc1ccccc1c2cc(Cl)nc(N)n2 |
| SMILES | CACTVS | 3.352 | COc1ccccc1c2cc(Cl)nc(N)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | COc1ccccc1c2cc(nc(n2)N)Cl |
| SMILES | OpenEye OEToolkits | 1.6.1 | COc1ccccc1c2cc(nc(n2)N)Cl |
| InChI | InChI | 1.03 | InChI=1S/C11H10ClN3O/c1-16-9-5-3-2-4-7(9)8-6-10(12)15-11(13)14-8/h2-6H,1H3,(H2,13,14,15) |
| InChIKey | InChI | 1.03 | SYQGHXNIIBJJKO-UHFFFAOYSA-N |
