3SM
2-methoxy-N-({6-[1-methyl-4-(methylamino)-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridin-7-yl]pyridin-2-yl}methyl)acetamide
Find entries where: 3SM
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 2-methoxy-N-({6-[1-methyl-4-(methylamino)-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridin-7-yl]pyridin-2-yl}methyl)acetamide |
| Identifiers | n/a |
| Formula | C19 H21 N7 O2 |
| Molecular Weight | 379.416 |
| Type | NON-POLYMER |
| Isomeric SMILES | CNc1c2c(c3cc([nH]c3n1)c4cccc(n4)CNC(=O)COC)n(cn2)C |
| InChI | InChI=1S/C19H21N7O2/c1-20-19-16-17(26(2)10-22-16)12-7-14(24-18(12)25-19)13-6-4-5-11(23-13)8-21-15(27)9-28-3/h4-7,10H,8-9H2,1-3H3,(H,21,27)(H2,20,24,25) |
| InChIKey | ULTCRVJUAZCGPP-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 49 |
| Chiral Atom Count | 0 |
| Bond Count | 52 |
| Aromatic Bond Count | 20 |
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL1923983 |
| PubChem | 24825710 |
| ChEMBL | CHEMBL1923983 |
| CCDC/CSD | SAMPUT |
