JXW
Summary
| Name: | 9-(2-chloroethyl)-8-methyl-purin-6-amine |
| Formula: | C8 H10 Cl N5 |
| Formal charge: | 0 |
| Formula weight: | 211.651 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 9-(2-chloroethyl)-8-methyl-purin-6-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H10ClN5/c1-5-13-6-7(10)11-4-12-8(6)14(5)3-2-9/h4H,2-3H2,1H3,(H2,10,11,12) |
| InChIKey | InChI | 1.03 | XOAPLONMSUKXAM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc2c(N)ncnc2n1CCCl |
| SMILES | CACTVS | 3.385 | Cc1nc2c(N)ncnc2n1CCCl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1nc2c(ncnc2n1CCCl)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1nc2c(ncnc2n1CCCl)N |
