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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H28ClN7O4S
Molecular Weight 534.031
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DESMETHYL EDOXABAN

SMILES

CN(C)C(=O)[C@H]1CC[C@H](NC(=O)C(=O)NC2=NC=C(Cl)C=C2)[C@@H](C1)NC(=O)C3=NC4=C(CNCC4)S3

InChI

InChIKey=GMRJAYKIRXDGFT-DUVNUKRYSA-N
InChI=1S/C23H28ClN7O4S/c1-31(2)23(35)12-3-5-14(27-19(32)20(33)30-18-6-4-13(24)10-26-18)16(9-12)28-21(34)22-29-15-7-8-25-11-17(15)36-22/h4,6,10,12,14,16,25H,3,5,7-9,11H2,1-2H3,(H,27,32)(H,28,34)(H,26,30,33)/t12-,14-,16+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
N-DESMETHYL EDOXABAN
Common Name English
EDOXABAN-M6
Common Name English
ETHANEDIAMIDE, N1-(5-CHLORO-2-PYRIDINYL)-N2-((1S,2R,4S)-4-((DIMETHYLAMINO)CARBONYL)-2-(((4,5,6,7-TETRAHYDROTHIAZOLO(5,4-C)PYRIDIN-2-YL)CARBONYL)AMINO)CYCLOHEXYL)-
Systematic Name English
Code System Code Type Description
CAS
778571-11-2
Created by admin on Sat Dec 16 14:16:27 GMT 2023 , Edited by admin on Sat Dec 16 14:16:27 GMT 2023
PRIMARY
PUBCHEM
16661115
Created by admin on Sat Dec 16 14:16:27 GMT 2023 , Edited by admin on Sat Dec 16 14:16:27 GMT 2023
PRIMARY
FDA UNII
OWE3Y1F1FV
Created by admin on Sat Dec 16 14:16:27 GMT 2023 , Edited by admin on Sat Dec 16 14:16:27 GMT 2023
PRIMARY