5E5
Summary
| Name: | 3-methyl-5-(pyridin-3-yl)-2H-pyrazolo[3,4-c]pyridine |
| Formula: | C12 H10 N4 |
| Formal charge: | 0 |
| Formula weight: | 210.235 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-methyl-5-(pyridin-3-yl)-2H-pyrazolo[3,4-c]pyridine |
| OpenEye OEToolkits | 1.9.2 | 3-methyl-5-pyridin-3-yl-2H-pyrazolo[3,4-c]pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c3c(nnc3cnc1c2cnccc2)C |
| InChI | InChI | 1.03 | InChI=1S/C12H10N4/c1-8-10-5-11(9-3-2-4-13-6-9)14-7-12(10)16-15-8/h2-7H,1H3,(H,15,16) |
| InChIKey | InChI | 1.03 | UQUBWQXJXQJXPB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1[nH]nc2cnc(cc12)c3cccnc3 |
| SMILES | CACTVS | 3.385 | Cc1[nH]nc2cnc(cc12)c3cccnc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1c2cc(ncc2n[nH]1)c3cccnc3 |
| SMILES | OpenEye OEToolkits | 1.9.2 | Cc1c2cc(ncc2n[nH]1)c3cccnc3 |
