4RI
Summary
| Name: | 6-hexyl-5-phenyl-pyrimidine-2,4-diamine |
| Formula: | C16 H22 N4 |
| Formal charge: | 0 |
| Formula weight: | 270.373 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-hexyl-5-phenyl-pyrimidine-2,4-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H22N4/c1-2-3-4-8-11-13-14(12-9-6-5-7-10-12)15(17)20-16(18)19-13/h5-7,9-10H,2-4,8,11H2,1H3,(H4,17,18,19,20) |
| InChIKey | InChI | 1.03 | DBCDYKFZHWOABJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCc1nc(N)nc(N)c1c2ccccc2 |
| SMILES | CACTVS | 3.385 | CCCCCCc1nc(N)nc(N)c1c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCc1c(c(nc(n1)N)N)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCc1c(c(nc(n1)N)N)c2ccccc2 |
