Analyte Name

T 26c Disodium Salt

CAS Number

869298-22-6

Molecular Formula

C24H19N3Na2O6S

Molecular Weight

523.47

Accurate Mass

523.08

SMILES

O=C(C1=CC=C(COCC2=CSC3=C2C(N=C(C(NCC4=CC(OC)=CC=C4)=O)N3[Na])=O)C=C1)O[Na]

InChI

InChI=1S/C24H21N3O6S.2Na/c1-32-18-4-2-3-15(9-18)10-25-22(29)20-26-21(28)19-17(13-34-23(19)27-20)12-33-11-14-5-7-16(8-6-14)24(30)31;;/h2-9,13H,10-12H2,1H3,(H3,25,26,27,28,29,30,31);;/q;2*+1/p-2

IUPAC

sodium 5-(((4-carboxylatobenzyl)oxy)methyl)-2-((3-methoxybenzyl)carbamoyl)-4-oxo-4H-thieno[2,3-d]pyrimidin-1-ide

Alternate CAS Number

Free acid 869296-13-9

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat