Analyte Name

YM 264-D4

Molecular Formula

C24H28D4N4OS • (C4H4O4)

Molecular Weight

544.7

Accurate Mass

544.26

SMILES

O=C([C@H]1NC(C2=C([2H])C([2H])=C([2H])N=C2[2H])SC1)N3CCN(CCC(C4=CC=CC=C4)(C)C)CC3.OC(/C=C/C(O)=O)=O

InChI

InChI=1S/C24H32N4OS.C4H4O4/c1-24(2,20-8-4-3-5-9-20)10-12-27-13-15-28(16-14-27)23(29)21-18-30-22(26-21)19-7-6-11-25-17-19;5-3(6)1-2-4(7)8/h3-9,11,17,21-22,26H,10,12-16,18H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t21-,22?;/m0./s1/i6D,7D,11D,17D;

IUPAC

(4-(3-methyl-3-phenylbutyl)piperazin-1-yl)((4R)-2-(pyridin-3-yl-d4)thiazolidin-4-yl)methanone fumarate

Unlabelled CAS Number

131888-54-5; Free Base: 126911-71-5

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat