Y9R
N-{(2S,3R)-4-[(4-aminobenzene-1-sulfonyl)(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl}-4-methyl-3-{[(4P)-4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzamide
Find entries where: Y9R
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | N-{(2S,3R)-4-[(4-aminobenzene-1-sulfonyl)(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl}-4-methyl-3-{[(4P)-4-(pyridin-3-yl)pyrimidin-2-yl]amino}benzamide |
| Identifiers | ~{N}-[(2~{S},3~{R})-4-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzamide |
| Formula | C37 H41 N7 O4 S |
| Molecular Weight | 679.831 |
| Type | NON-POLYMER |
| Isomeric SMILES | Cc1ccc(cc1Nc2nccc(n2)c3cccnc3)C(=O)N[C@@H](Cc4ccccc4)[C@@H](CN(CC(C)C)S(=O)(=O)c5ccc(cc5)N)O |
| InChI | InChI=1S/C37H41N7O4S/c1-25(2)23-44(49(47,48)31-15-13-30(38)14-16-31)24-35(45)34(20-27-8-5-4-6-9-27)41-36(46)28-12-11-26(3)33(21-28)43-37-40-19-17-32(42-37)29-10-7-18-39-22-29/h4-19,21-22,25,34-35,45H,20,23-24,38H2,1-3H3,(H,41,46)(H,40,42,43)/t34-,35+/m0/s1 |
| InChIKey | RKIVUCDKNNHGHG-OIDHKYIRSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 90 |
| Chiral Atom Count | 2 |
| Bond Count | 94 |
| Aromatic Bond Count | 30 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 168069208 |
