Analyte Name

Desthiazolidino Teneligliptin N-(2-Thio-ethyl) Carboxamide

CAS Number

2987972-98-3

Molecular Formula

C21H30N6OS

Molecular Weight

414.57

Accurate Mass

414.22

SMILES

O=C(NCCS)[C@H]1NC[C@@H](N(CC2)CCN2C3=CC(C)=NN3C4=CC=CC=C4)C1

InChI

InChI=1S/C21H30N6OS/c1-16-13-20(27(24-16)17-5-3-2-4-6-17)26-10-8-25(9-11-26)18-14-19(23-15-18)21(28)22-7-12-29/h2-6,13,18-19,23,29H,7-12,14-15H2,1H3,(H,22,28)/t18-,19-/m0/s1

IUPAC

(2S,4S)-N-(2-mercaptoethyl)-4-(4-(3-methyl-1-phenyl-1H-pyrazol-5-yl)piperazin-1-yl)pyrrolidine-2-carboxamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat