Analyte Name

(3E)-4-(Acetylthio)-alpha-(2-chlorophenyl)-3-(2-ethoxy-2-oxoethylidene)-1-piperidineacetic Acid Methyl Ester(Mixture of Diastereomers)

CAS Number

204204-75-1

Molecular Formula

C20H24ClNO5S

Molecular Weight

425.93

Accurate Mass

425.1064

SMILES

CCOC(=O)\C=C\1/CN(CCC1SC(=O)C)C(C(=O)OC)c2ccccc2Cl

InChI

InChI=1S/C20H24ClNO5S/c1-4-27-18(24)11-14-12-22(10-9-17(14)28-13(2)23)19(20(25)26-3)15-7-5-6-8-16(15)21/h5-8,11,17,19H,4,9-10,12H2,1-3H3/b14-11+

IUPAC

methyl 2-[(3E)-4-acetylsulfanyl-3-(2-ethoxy-2-oxoethylidene)piperidin-1-yl]-2-(2-chlorophenyl)acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat