Ent-Edoxaban

Product Specifications

CAS Number

1255529-23-7

Synonyms

N-(5-Chloropyridin-2-yl)-N'-[(1R,2S,4R)-4-[(dimethylamino)carbonyl]-2-[[(5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridin-2-yl)carbonyl]amino]cyclohexyl]ethanediamide; Edoxaban Impurity I;

Hazard Statement

No Data Available

Smiles

O=C([C@H]1C[C@H](NC(C2=NC3=C(CN(CC3)C)S2)=O)[C@H](NC(C(NC4=CC=C(C=N4)Cl)=O)=O)CC1)N(C)C

Molecular Formula

C24H30ClN7O4S

Molecular Weight

548.06

InChI

InChI=1S/C24H30ClN7O4S/c1-31(2)24(36)13-4-6-15(27-20(33)21(34)30-19-7-5-14(25)11-26-19)17(10-13)28-22(35)23-29-16-8-9-32(3)12-18(16)37-23/h5,7,11,13,15,17H,4,6,8-10,12H2,1-3H3,(H,27,33)(H,28,35)(H,26,30,34)/t13-,15-,17+/m1/s1

Additionnal Information

IUPAC name: N1-(5-chloropyridin-2-yl)-N2-((1R,2S,4R)-4-(dimethylcarbamoyl)-2-(5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxamido)cyclohexyl)oxalamide