UWD
Summary
| Name: | N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine |
| Formula: | C8 H10 N4 |
| Formal charge: | 0 |
| Formula weight: | 162.192 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine |
| OpenEye OEToolkits | 2.0.7 | ~{N}-methyl-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2c(n1ccccc1n2)CNC |
| InChI | InChI | 1.03 | InChI=1S/C8H10N4/c1-9-6-8-11-10-7-4-2-3-5-12(7)8/h2-5,9H,6H2,1H3 |
| InChIKey | InChI | 1.03 | UQXCTICEXNDHAR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCc1nnc2ccccn12 |
| SMILES | CACTVS | 3.385 | CNCc1nnc2ccccn12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNCc1nnc2n1cccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CNCc1nnc2n1cccc2 |
