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Details

Stereochemistry ACHIRAL
Molecular Formula C22H20ClN5O3
Molecular Weight 437.879
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-DESMETHYL BETRIXABAN

SMILES

CN(C)C(=N)C1=CC=C(C=C1)C(=O)NC2=C(C=C(O)C=C2)C(=O)NC3=NC=C(Cl)C=C3

InChI

InChIKey=XALQAROEPNDIFZ-UHFFFAOYSA-N
InChI=1S/C22H20ClN5O3/c1-28(2)20(24)13-3-5-14(6-4-13)21(30)26-18-9-8-16(29)11-17(18)22(31)27-19-10-7-15(23)12-25-19/h3-12,24,29H,1-2H3,(H,26,30)(H,25,27,31)

HIDE SMILES / InChI

Molecular Formula C22H20ClN5O3
Molecular Weight 437.879
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:54:18 GMT 2023
Edited
by admin
on Sat Dec 16 13:54:18 GMT 2023
Record UNII
J86KUA84SP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-DESMETHYL BETRIXABAN
Common Name English
N-(5-CHLORO-2-PYRIDINYL)-2-((4-((DIMETHYLAMINO)IMINOMETHYL)BENZOYL)AMINO)-5-HYDROXYBENZAMIDE
Systematic Name English
PRT-058326
Code English
BENZAMIDE, N-(5-CHLORO-2-PYRIDINYL)-2-((4-((DIMETHYLAMINO)IMINOMETHYL)BENZOYL)AMINO)-5-HYDROXY-
Systematic Name English
Code System Code Type Description
CAS
1616693-59-4
Created by admin on Sat Dec 16 13:54:19 GMT 2023 , Edited by admin on Sat Dec 16 13:54:19 GMT 2023
PRIMARY
FDA UNII
J86KUA84SP
Created by admin on Sat Dec 16 13:54:19 GMT 2023 , Edited by admin on Sat Dec 16 13:54:19 GMT 2023
PRIMARY
PUBCHEM
68023123
Created by admin on Sat Dec 16 13:54:19 GMT 2023 , Edited by admin on Sat Dec 16 13:54:19 GMT 2023
PRIMARY
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INHIBITOR
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