XEZ
Summary
| Name: | 6-(1H-PYRAZOL-3-YL)-3-(1H-PYRAZOL-4-YL)IMIDAZO[1,2-A]PYRAZINE |
| Formula: | C12 H9 N7 |
| Formal charge: | 0 |
| Formula weight: | 251.247 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-(1H-pyrazol-3-yl)-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazine |
| OpenEye OEToolkits | 1.6.1 | 3-(1H-pyrazol-3-yl)-6-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2c3n(c(c1nncc1)c2)cc(nc3)c4cnnc4 |
| SMILES_CANONICAL | CACTVS | 3.352 | [nH]1ccc(n1)c2cnc3cnc(cn23)c4c[nH]nc4 |
| SMILES | CACTVS | 3.352 | [nH]1ccc(n1)c2cnc3cnc(cn23)c4c[nH]nc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1c[nH]nc1c2cnc3n2cc(nc3)c4c[nH]nc4 |
| SMILES | OpenEye OEToolkits | 1.6.1 | c1c[nH]nc1c2cnc3n2cc(nc3)c4c[nH]nc4 |
| InChI | InChI | 1.03 | InChI=1S/C12H9N7/c1-2-15-18-9(1)11-5-14-12-6-13-10(7-19(11)12)8-3-16-17-4-8/h1-7H,(H,15,18)(H,16,17) |
| InChIKey | InChI | 1.03 | ALMSMDKNGFZAEU-UHFFFAOYSA-N |
