Analyte Name

Deschloro Venetoclax

Molecular Formula

C45 H51 N7 O7 S

Molecular Weight

833.994

Accurate Mass

833.357

SMILES

CC1(C)CCC(=C(C1)c2ccccc2)CN3CCN(CC3)c4ccc(C(=O)NS(=O)(=O)c5ccc(NCC6CCOCC6)c(c5)[N+](=O)[O-])c(Oc7cnc8[nH]ccc8c7)c4

InChI

InChI=1S/C45H51N7O7S/c1-45(2)16-12-34(39(27-45)32-6-4-3-5-7-32)30-50-18-20-51(21-19-50)35-8-10-38(42(25-35)59-36-24-33-13-17-46-43(33)48-29-36)44(53)49-60(56,57)37-9-11-40(41(26-37)52(54)55)47-28-31-14-22-58-23-15-31/h3-11,13,17,24-26,29,31,47H,12,14-16,18-23,27-28,30H2,1-2H3,(H,46,48)(H,49,53)

IUPAC

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

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat