Analyte Name

Dasabuvir Naphthyl-d6

Molecular Formula

C26 D6 H21 N3 O5 S

Molecular Weight

499.612

Accurate Mass

499.205

SMILES

[2H]c1c([2H])c2c([2H])c(c([2H])c([2H])c2c([2H])c1NS(=O)(=O)C)c3cc(cc(c3OC)C(C)(C)C)N4C=CC(=O)NC4=O

InChI

InChI=1S/C26H27N3O5S/c1-26(2,3)22-15-20(29-11-10-23(30)27-25(29)31)14-21(24(22)34-4)18-7-6-17-13-19(28-35(5,32)33)9-8-16(17)12-18/h6-15,28H,1-5H3,(H,27,30,31)/i6D,7D,8D,9D,12D,13D

IUPAC

N-[6-[3-tert-butyl-5-(2,4-dioxopyrimidin-1-yl)-2-methoxyphenyl]-1,3,4,5,7,8-hexadeuterionaphthalen-2-yl]methanesulfonamide

Unlabelled CAS Number

1132935-63-7

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat