CQK
Summary
| Name: | ~{N}-oxidanyl-4-(2~{H}-1,2,3,4-tetrazol-5-yl)pyridine-2-carboxamide |
| Formula: | C7 H6 N6 O2 |
| Formal charge: | 0 |
| Formula weight: | 206.162 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-oxidanyl-4-(2~{H}-1,2,3,4-tetrazol-5-yl)pyridine-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H6N6O2/c14-7(11-15)5-3-4(1-2-8-5)6-9-12-13-10-6/h1-3,15H,(H,11,14)(H,9,10,12,13) |
| InChIKey | InChI | 1.03 | ICLVJVGNXROVLL-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)c1cc(ccn1)c2n[nH]nn2 |
| SMILES | CACTVS | 3.385 | ONC(=O)c1cc(ccn1)c2n[nH]nn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cnc(cc1c2n[nH]nn2)C(=O)NO |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cnc(cc1c2n[nH]nn2)C(=O)NO |
