Analyte Name

Lapatinib-d7 Ditosylate

CAS Number

1009307-24-7

Molecular Formula

C43H35D7ClFN4O10S3

Molecular Weight

932.5

Accurate Mass

931.22

SMILES

FC1=CC(COC(C(Cl)=C2)=CC=C2NC3=NC=NC4=CC=C(C5=CC=C(CNC([2H])([2H])C([2H])([2H])S(=O)(C([2H])([2H])[2H])=O)O5)C=C43)=CC=C1.CC6=CC=C(S(=O)(O)=O)C=C6.CC7=CC=C(S(=O)(O)=O)C=C7

InChI

InChI=1S/C29H26ClFN4O4S.2C7H8O3S/c1-40(36,37)12-11-32-16-23-7-10-27(39-23)20-5-8-26-24(14-20)29(34-18-33-26)35-22-6-9-28(25(30)15-22)38-17-19-3-2-4-21(31)13-19;2*1-6-2-4-7(5-3-6)11(8,9)10/h2-10,13-15,18,32H,11-12,16-17H2,1H3,(H,33,34,35);2*2-5H,1H3,(H,8,9,10)/i1D3,11D2,12D2;;

IUPAC

N-(3-chloro-4-((3-fluorobenzyl)oxy)phenyl)-6-(5-(((2-((methyl-d3)sulfonyl)ethyl-1,1,2,2-d4)amino)methyl)furan-2-yl)quinazolin-4-amine bis(4-methylbenzenesulfonate)

Unlabelled CAS Number

388082-77-7

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat