Z2M
Summary
| Name: | 3-cyclopropyl-4-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridine |
| Formula: | C13 H11 N3 O |
| Formal charge: | 0 |
| Formula weight: | 225.246 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-cyclopropyl-4-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridine |
| OpenEye OEToolkits | 1.7.6 | 3-cyclopropyl-4-(furan-2-yl)-1H-pyrazolo[3,4-b]pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n3c(c2c(c1occc1)ccnc2n3)C4CC4 |
| InChI | InChI | 1.03 | InChI=1S/C13H11N3O/c1-2-10(17-7-1)9-5-6-14-13-11(9)12(15-16-13)8-3-4-8/h1-2,5-8H,3-4H2,(H,14,15,16) |
| InChIKey | InChI | 1.03 | CVODVHVJEVVKKB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | C1CC1c2n[nH]c3nccc(c4occc4)c23 |
| SMILES | CACTVS | 3.370 | C1CC1c2n[nH]c3nccc(c4occc4)c23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(oc1)c2ccnc3c2c(n[nH]3)C4CC4 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(oc1)c2ccnc3c2c(n[nH]3)C4CC4 |
