Analyte Name

2-Oxo Mirabegron

CAS Number

1684453-05-1

Molecular Formula

C21 H22 N4 O3 S

Molecular Weight

410.489

Accurate Mass

410.141

SMILES

Nc1nc(CC(=O)Nc2ccc(CCNC(=O)[C@H](O)c3ccccc3)cc2)cs1

InChI

InChI=1S/C21H22N4O3S/c22-21-25-17(13-29-21)12-18(26)24-16-8-6-14(7-9-16)10-11-23-20(28)19(27)15-4-2-1-3-5-15/h1-9,13,19,27H,10-12H2,(H2,22,25)(H,23,28)(H,24,26)/t19-/m1/s1

IUPAC

(2R)-N-[2-[4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]phenyl]ethyl]-2-hydroxy-2-phenylacetamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat