6RT
Summary
| Name: | 2,4-bis(aziridin-1-yl)-6-(1-phenylpyrrol-2-yl)-1,3,5-triazine |
| Formula: | C17 H16 N6 |
| Formal charge: | 0 |
| Formula weight: | 304.349 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 2,4-bis(aziridin-1-yl)-6-(1-phenylpyrrol-2-yl)-1,3,5-triazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C17H16N6/c1-2-5-13(6-3-1)23-8-4-7-14(23)15-18-16(21-9-10-21)20-17(19-15)22-11-12-22/h1-8H,9-12H2 |
| InChIKey | InChI | 1.03 | DAZONCQAIYYVKR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CN1c2nc(nc(n2)c3cccn3c4ccccc4)N5CC5 |
| SMILES | CACTVS | 3.385 | C1CN1c2nc(nc(n2)c3cccn3c4ccccc4)N5CC5 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)n2cccc2c3nc(nc(n3)N4CC4)N5CC5 |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)n2cccc2c3nc(nc(n3)N4CC4)N5CC5 |
