Products 1391107-89-3

CAS 1391107-89-3 appears in our catalog under these names: BM-1197, 99.48%, BM-1197, 99.43%. Offered by: MedChemExpress, Chemat. Available pack sizes: 1 mg, 5 mg, 10mM/1mL, 10 mg, 1mg.

Structural formula: {0} (CAS {1})

N-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-4-[[(2R)-4-(4-hydroxypiperidin-1-yl)-1-phenylsulfanylbutan-2-yl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide (CAS 1391107-89-3) is a chemical compound with the molecular formula C53H59ClF4N6O7S4 and a molecular weight of 1131.8 g/mol. IUPAC name: N-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-4-[[(2R)-4-(4-hydroxypiperidin-1-yl)-1-phenylsulfanylbutan-2-yl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide. InChIKey: DMKVQMFONHHNMZ-HUESYALOSA-N.

Identity
Molecular formulaC53H59ClF4N6O7S4
Molecular weight1131.8 g/mol
IUPAC nameN-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-4-[[(2R)-4-(4-hydroxypiperidin-1-yl)-1-phenylsulfanylbutan-2-yl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide
InChIKeyDMKVQMFONHHNMZ-HUESYALOSA-N
SMILESCC1=C(C(=C(N1C(C)C)C2=CC=C(C=C2)Cl)C3=CC(=CC(=C3)F)N4CCN(CC4)C5=CC=C(C=C5)NS(=O)(=O)C6=CC(=C(C=C6)N[C@H](CCN7CCC(CC7)O)CSC8=CC=CC=C8)S(=O)(=O)C(F)(F)F)S(=O)(=O)C

Computed by PubChem (NCBI)