NYX
Summary
| Name: | 2-chloranyl-~{N}-(1~{H}-indazol-5-ylmethyl)ethanamide |
| Formula: | C10 H10 Cl N3 O |
| Formal charge: | 0 |
| Formula weight: | 223.659 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 2-chloranyl-~{N}-(1~{H}-indazol-5-ylmethyl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H10ClN3O/c11-4-10(15)12-5-7-1-2-9-8(3-7)6-13-14-9/h1-3,6H,4-5H2,(H,12,15)(H,13,14) |
| InChIKey | InChI | 1.06 | ISIFBXASHNTXOY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ClCC(=O)NCc1ccc2[nH]ncc2c1 |
| SMILES | CACTVS | 3.385 | ClCC(=O)NCc1ccc2[nH]ncc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc2c(cc1CNC(=O)CCl)cn[nH]2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc2c(cc1CNC(=O)CCl)cn[nH]2 |
