A1IF7
Summary
| Name: | Enarodustat |
| Synonyms: | 2-[[7-oxidanylidene-5-(2-phenylethyl)-3H-[1,2,4]triazolo[1,5-a]pyridin-8-yl]carbonylamino]ethanoic acid |
| Formula: | C17 H16 N4 O4 |
| Formal charge: | 0 |
| Formula weight: | 340.333 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[[7-oxidanylidene-5-(2-phenylethyl)-3~{H}-[1,2,4]triazolo[1,5-a]pyridin-8-yl]carbonylamino]ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H16N4O4/c22-13-8-12(7-6-11-4-2-1-3-5-11)21-16(19-10-20-21)15(13)17(25)18-9-14(23)24/h1-5,8,10H,6-7,9H2,(H,18,25)(H,19,20)(H,23,24) |
| InChIKey | InChI | 1.06 | FJYRBJKWDXVHHO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CNC(=O)C1=C2N=CNN2C(=CC1=O)CCc3ccccc3 |
| SMILES | CACTVS | 3.385 | OC(=O)CNC(=O)C1=C2N=CNN2C(=CC1=O)CCc3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CCC2=CC(=O)C(=C3N2NC=N3)C(=O)NCC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)CCC2=CC(=O)C(=C3N2NC=N3)C(=O)NCC(=O)O |
