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Details

Stereochemistry ACHIRAL
Molecular Formula C16H13Br2N5O2
Molecular Weight 467.115
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(4-BROMOPHENYL)-6-(2-((5-BROMO-2-PYRIMIDINYL)OXY)ETHOXY)-4-PYRIMIDINAMINE

SMILES

NC1=NC=NC(OCCOC2=NC=C(Br)C=N2)=C1C3=CC=C(Br)C=C3

InChI

InChIKey=LFEPQTGGEXKQEY-UHFFFAOYSA-N
InChI=1S/C16H13Br2N5O2/c17-11-3-1-10(2-4-11)13-14(19)22-9-23-15(13)24-5-6-25-16-20-7-12(18)8-21-16/h1-4,7-9H,5-6H2,(H2,19,22,23)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
5-(4-BROMOPHENYL)-6-(2-((5-BROMO-2-PYRIMIDINYL)OXY)ETHOXY)-4-PYRIMIDINAMINE
Systematic Name English
MACITENTAN METABOLITE M3
Common Name English
4-PYRIMIDINAMINE, 5-(4-BROMOPHENYL)-6-(2-((5-BROMO-2-PYRIMIDINYL)OXY)ETHOXY)-
Systematic Name English
ACT-080803
Code English
Code System Code Type Description
FDA UNII
51YSQ21S7O
Created by admin on Sat Dec 16 14:57:16 GMT 2023 , Edited by admin on Sat Dec 16 14:57:16 GMT 2023
PRIMARY
CAS
1433875-21-8
Created by admin on Sat Dec 16 14:57:16 GMT 2023 , Edited by admin on Sat Dec 16 14:57:16 GMT 2023
PRIMARY
PUBCHEM
67041378
Created by admin on Sat Dec 16 14:57:16 GMT 2023 , Edited by admin on Sat Dec 16 14:57:16 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of MACITENTAN
NIH
NCATS
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