363
Summary
| Name: | 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine |
| Formula: | C9 H7 N5 |
| Formal charge: | 0 |
| Formula weight: | 185.185 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine |
| OpenEye OEToolkits | 1.7.6 | 2-(1H-pyrazol-4-yl)-5H-pyrrolo[2,3-b]pyrazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1c3ccnc3ncc1c2cnnc2 |
| InChI | InChI | 1.03 | InChI=1S/C9H7N5/c1-2-10-9-7(1)14-8(5-11-9)6-3-12-13-4-6/h1-5H,(H,10,11)(H,12,13) |
| InChIKey | InChI | 1.03 | LTFQPYDMHBLAGZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | [nH]1cc(cn1)c2cnc3[nH]ccc3n2 |
| SMILES | CACTVS | 3.385 | [nH]1cc(cn1)c2cnc3[nH]ccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1c[nH]c2c1nc(cn2)c3c[nH]nc3 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1c[nH]c2c1nc(cn2)c3c[nH]nc3 |
