O10
Summary
| Name: | (5M)-5-(5-bromo-2-chloropyrimidin-4-yl)-5H-pyrrolo[3,2-d]pyrimidine |
| Formula: | C10 H5 Br Cl N5 |
| Formal charge: | 0 |
| Formula weight: | 310.537 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (5M)-5-(5-bromo-2-chloropyrimidin-4-yl)-5H-pyrrolo[3,2-d]pyrimidine |
| OpenEye OEToolkits | 2.0.7 | 5-(5-bromanyl-2-chloranyl-pyrimidin-4-yl)pyrrolo[3,2-d]pyrimidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Brc1cnc(Cl)nc1n1ccc2ncncc21 |
| InChI | InChI | 1.03 | InChI=1S/C10H5BrClN5/c11-6-3-14-10(12)16-9(6)17-2-1-7-8(17)4-13-5-15-7/h1-5H |
| InChIKey | InChI | 1.03 | VSZVVLDJLHIOHV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ncc(Br)c(n1)n2ccc3ncncc23 |
| SMILES | CACTVS | 3.385 | Clc1ncc(Br)c(n1)n2ccc3ncncc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cn(c2c1ncnc2)c3c(cnc(n3)Cl)Br |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cn(c2c1ncnc2)c3c(cnc(n3)Cl)Br |
