Analytenname

2'-Oxo Venetoclax

Molekularformel

C45 H48 Cl N7 O8 S

Molekulargewicht

882.423

Genaue Masse

881.297

SMILES

CC1(C)CCC(=C(C1)c2ccc(Cl)cc2)CN3CCN(C(=O)C3)c4ccc(C(=O)NS(=O)(=O)c5ccc(NCC6CCOCC6)c(c5)[N+](=O)[O-])c(Oc7cnc8[nH]ccc8c7)c4

InChI

InChI=1S/C45H48ClN7O8S/c1-45(2)15-11-32(38(24-45)30-3-5-33(46)6-4-30)27-51-17-18-52(42(54)28-51)34-7-9-37(41(22-34)61-35-21-31-12-16-47-43(31)49-26-35)44(55)50-62(58,59)36-8-10-39(40(23-36)53(56)57)48-25-29-13-19-60-20-14-29/h3-10,12,16,21-23,26,29,48H,11,13-15,17-20,24-25,27-28H2,1-2H3,(H,47,49)(H,50,55)

IUPAC

4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]-2-oxopiperazin-1-yl]-N-[3-nitro-4-(oxan-4-ylmethylamino)phenyl]sulfonyl-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzamide

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produktformat

Neat