A1KEP
Summary
| Name: | ~{N},3,8-trimethyl-~{N}-(pyridin-2-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine |
| Formula: | C14 H16 N6 |
| Formal charge: | 0 |
| Formula weight: | 268.317 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N},3,8-trimethyl-~{N}-(pyridin-2-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C14H16N6/c1-10-8-13(18-20-11(2)16-17-14(10)20)19(3)9-12-6-4-5-7-15-12/h4-8H,9H2,1-3H3 |
| InChIKey | InChI | 1.06 | KQPXNMUAHMIHHD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(Cc1ccccn1)c2cc(C)c3nnc(C)n3n2 |
| SMILES | CACTVS | 3.385 | CN(Cc1ccccn1)c2cc(C)c3nnc(C)n3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(nn2c1nnc2C)N(C)Cc3ccccn3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(nn2c1nnc2C)N(C)Cc3ccccn3 |
