2OO
4-[1-(4-amino-1,3,5-triazin-2-yl)-2-(ethylamino)-1H-benzimidazol-6-yl]-2-methylbut-3-yn-2-ol
Find entries where: 2OO
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 4-[1-(4-amino-1,3,5-triazin-2-yl)-2-(ethylamino)-1H-benzimidazol-6-yl]-2-methylbut-3-yn-2-ol |
| Identifiers | 4-[3-(4-azanyl-1,3,5-triazin-2-yl)-2-(ethylamino)benzimidazol-5-yl]-2-methyl-but-3-yn-2-ol |
| Formula | C17 H19 N7 O |
| Molecular Weight | 337.379 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCNc1nc2ccc(cc2n1c3ncnc(n3)N)C#CC(C)(C)O |
| InChI | InChI=1S/C17H19N7O/c1-4-19-15-22-12-6-5-11(7-8-17(2,3)25)9-13(12)24(15)16-21-10-20-14(18)23-16/h5-6,9-10,25H,4H2,1-3H3,(H,19,22)(H2,18,20,21,23) |
| InChIKey | NDZPPXQOOUNQTQ-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 44 |
| Chiral Atom Count | 0 |
| Bond Count | 46 |
| Aromatic Bond Count | 16 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 72725813 |
| ChEMBL | CHEMBL3128055 |
