Products 2379390-76-6
CAS 2379390-76-6 is the registry number for PARP7-probe-1. Offered by: MedChemExpress. Available pack sizes: Get quote.
5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[6-[[2-[4-[[2-[6-oxo-5-(trifluoromethyl)-1H-pyridazin-4-yl]-1,3-dihydroisoindol-5-yl]oxy]piperidin-1-yl]acetyl]amino]hexyl]pentanamide (CAS 2379390-76-6) is a chemical compound with the molecular formula C36H49F3N8O5S and a molecular weight of 762.9 g/mol. IUPAC name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[6-[[2-[4-[[2-[6-oxo-5-(trifluoromethyl)-1H-pyridazin-4-yl]-1,3-dihydroisoindol-5-yl]oxy]piperidin-1-yl]acetyl]amino]hexyl]pentanamide. InChIKey: JBOIALWTEFWUEK-GSZYCOFVSA-N.
| Molecular formula | C36H49F3N8O5S |
|---|---|
| Molecular weight | 762.9 g/mol |
| IUPAC name | 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[6-[[2-[4-[[2-[6-oxo-5-(trifluoromethyl)-1H-pyridazin-4-yl]-1,3-dihydroisoindol-5-yl]oxy]piperidin-1-yl]acetyl]amino]hexyl]pentanamide |
| InChIKey | JBOIALWTEFWUEK-GSZYCOFVSA-N |
| SMILES | C1CN(CCC1OC2=CC3=C(CN(C3)C4=C(C(=O)NN=C4)C(F)(F)F)C=C2)CC(=O)NCCCCCCNC(=O)CCCC[C@H]5[C@@H]6[C@H](CS5)NC(=O)N6 |
Computed by PubChem (NCBI)
Synonyms:
orb1982085, JBOIALWTEFWUEK-GSZYCOFVSA-N