DX2
Summary
| Name: | 6-phenylpteridine-2,4,7-triamine |
| Formula: | C12 H11 N7 |
| Formal charge: | 0 |
| Formula weight: | 253.263 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 6-phenylpteridine-2,4,7-triamine |
| OpenEye OEToolkits | 1.5.0 | 6-phenylpteridine-2,4,7-triamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1c3c(nc(c1c2ccccc2)N)nc(nc3N)N |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1nc(N)c2nc(c3ccccc3)c(N)nc2n1 |
| SMILES | CACTVS | 3.341 | Nc1nc(N)c2nc(c3ccccc3)c(N)nc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2c(nc3c(n2)c(nc(n3)N)N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)c2c(nc3c(n2)c(nc(n3)N)N)N |
| InChI | InChI | 1.03 | InChI=1S/C12H11N7/c13-9-7(6-4-2-1-3-5-6)16-8-10(14)18-12(15)19-11(8)17-9/h1-5H,(H6,13,14,15,17,18,19) |
| InChIKey | InChI | 1.03 | FNYLWPVRPXGIIP-UHFFFAOYSA-N |
