NW1
Summary
| Name: | 6-CYCLOHEXYLMETHYLOXY-5-NITROSO-PYRIMIDINE-2,4-DIAMINE |
| Formula: | C11 H17 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 251.285 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 6-(cyclohexylmethoxy)-5-nitrosopyrimidine-2,4-diamine |
| OpenEye OEToolkits | 1.5.0 | 6-(cyclohexylmethoxy)-5-nitroso-pyrimidine-2,4-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=Nc2c(OCC1CCCCC1)nc(nc2N)N |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1nc(N)c(N=O)c(OCC2CCCCC2)n1 |
| SMILES | CACTVS | 3.341 | Nc1nc(N)c(N=O)c(OCC2CCCCC2)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1CCC(CC1)COc2c(c(nc(n2)N)N)N=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1CCC(CC1)COc2c(c(nc(n2)N)N)N=O |
| InChI | InChI | 1.03 | InChI=1S/C11H17N5O2/c12-9-8(16-17)10(15-11(13)14-9)18-6-7-4-2-1-3-5-7/h7H,1-6H2,(H4,12,13,14,15) |
| InChIKey | InChI | 1.03 | DGWXOLHKVGDQLN-UHFFFAOYSA-N |
