A1IU7
Summary
| Name: | ~{N}-[2-(1~{H}-pyrrolo[2,3-b]pyridin-5-yl)phenyl]propanamide |
| Formula: | C16 H15 N3 O |
| Formal charge: | 0 |
| Formula weight: | 265.31 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[2-(1~{H}-pyrrolo[2,3-b]pyridin-5-yl)phenyl]propanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H15N3O/c1-2-15(20)19-14-6-4-3-5-13(14)12-9-11-7-8-17-16(11)18-10-12/h3-10H,2H2,1H3,(H,17,18)(H,19,20) |
| InChIKey | InChI | 1.06 | ZSLQYIORPJSVTD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC(=O)Nc1ccccc1c2cnc3[nH]ccc3c2 |
| SMILES | CACTVS | 3.385 | CCC(=O)Nc1ccccc1c2cnc3[nH]ccc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC(=O)Nc1ccccc1c2cc3cc[nH]c3nc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(=O)Nc1ccccc1c2cc3cc[nH]c3nc2 |
