A1AD3
Summary
| Name: | (1M)-5-amino-1-(1,8-naphthyridin-3-yl)-1H-imidazole-4-carboxamide |
| Formula: | C12 H10 N6 O |
| Formal charge: | 0 |
| Formula weight: | 254.247 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1M)-5-amino-1-(1,8-naphthyridin-3-yl)-1H-imidazole-4-carboxamide |
| OpenEye OEToolkits | 2.0.7 | 5-azanyl-1-(1,8-naphthyridin-3-yl)imidazole-4-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(=O)c1ncn(c2cnc3ncccc3c2)c1N |
| InChI | InChI | 1.06 | InChI=1S/C12H10N6O/c13-10-9(11(14)19)17-6-18(10)8-4-7-2-1-3-15-12(7)16-5-8/h1-6H,13H2,(H2,14,19) |
| InChIKey | InChI | 1.06 | XEVIHIZMGQWKDF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1ncn(c2cnc3ncccc3c2)c1N |
| SMILES | CACTVS | 3.385 | NC(=O)c1ncn(c2cnc3ncccc3c2)c1N |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2cc(cnc2nc1)n3cnc(c3N)C(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2cc(cnc2nc1)n3cnc(c3N)C(=O)N |
