69P
Summary
| Name: | 6-piperazin-1-yl-9H-purine |
| Formula: | C9 H12 N6 |
| Formal charge: | 0 |
| Formula weight: | 204.232 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-(piperazin-1-yl)-9H-purine |
| OpenEye OEToolkits | 1.7.0 | 6-piperazin-1-yl-9H-purine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2cnc1c(ncn1)c2N3CCNCC3 |
| SMILES_CANONICAL | CACTVS | 3.370 | C1CN(CCN1)c2ncnc3[nH]cnc23 |
| SMILES | CACTVS | 3.370 | C1CN(CCN1)c2ncnc3[nH]cnc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1[nH]c2c(n1)c(ncn2)N3CCNCC3 |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1[nH]c2c(n1)c(ncn2)N3CCNCC3 |
| InChI | InChI | 1.03 | InChI=1S/C9H12N6/c1-3-15(4-2-10-1)9-7-8(12-5-11-7)13-6-14-9/h5-6,10H,1-4H2,(H,11,12,13,14) |
| InChIKey | InChI | 1.03 | FFNVVVLETZYYJN-UHFFFAOYSA-N |
