A1AM1
Summary
| Name: | N-{[(4R)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}propanamide |
| Formula: | C10 H16 N4 O |
| Formal charge: | 0 |
| Formula weight: | 208.26 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-{[(4R)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}propanamide |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CCC(=O)NCc1nnc2CCCCn12 |
| InChI | InChI | 1.06 | InChI=1S/C10H16N4O/c1-2-10(15)11-7-9-13-12-8-5-3-4-6-14(8)9/h2-7H2,1H3,(H,11,15) |
| InChIKey | InChI | 1.06 | IOOTXFHTMOUUHM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC(=O)NCc1nnc2CCCCn12 |
| SMILES | CACTVS | 3.385 | CCC(=O)NCc1nnc2CCCCn12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC(=O)NCc1nnc2n1CCCC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)NCc1nnc2n1CCCC2 |
