JUW
Summary
| Name: | 4-(1-methylindol-3-yl)pyrimidin-2-amine |
| Formula: | C13 H12 N4 |
| Formal charge: | 0 |
| Formula weight: | 224.261 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-(1-methylindol-3-yl)pyrimidin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H12N4/c1-17-8-10(9-4-2-3-5-12(9)17)11-6-7-15-13(14)16-11/h2-8H,1H3,(H2,14,15,16) |
| InChIKey | InChI | 1.03 | IEYXYKBZJHPKGV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1cc(c2ccnc(N)n2)c3ccccc13 |
| SMILES | CACTVS | 3.385 | Cn1cc(c2ccnc(N)n2)c3ccccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cn1cc(c2c1cccc2)c3ccnc(n3)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cn1cc(c2c1cccc2)c3ccnc(n3)N |
