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Details

Stereochemistry ACHIRAL
Molecular Formula C26H27N5O7S
Molecular Weight 553.587
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDROXY-DEMETHOXYBOSENTAN

SMILES

CC(C)(CO)C1=CC=C(C=C1)S(=O)(=O)NC2=C(OC3=CC=CC=C3O)C(OCCO)=NC(=N2)C4=NC=CC=N4

InChI

InChIKey=JXXCMZWROOURSZ-UHFFFAOYSA-N
InChI=1S/C26H27N5O7S/c1-26(2,16-33)17-8-10-18(11-9-17)39(35,36)31-22-21(38-20-7-4-3-6-19(20)34)25(37-15-14-32)30-24(29-22)23-27-12-5-13-28-23/h3-13,32-34H,14-16H2,1-2H3,(H,29,30,31)

HIDE SMILES / InChI

Approval Year

Name Type Language
HYDROXY-DEMETHOXYBOSENTAN
Common Name English
RO 64-1056
Code English
4-(2-HYDROXY-1,1-DIMETHYLETHYL)-N-(6-(2-HYDROXYETHOXY)-5-(2-HYDROXYPHENOXY)(2,2'-BIPYRIMIDIN)-4-YL)BENZENESULFONAMIDE
Systematic Name English
BENZENESULFONAMIDE, 4-(2-HYDROXY-1,1-DIMETHYLETHYL)-N-(6-(2-HYDROXYETHOXY)-5-(2-HYDROXYPHENOXY)(2,2'-BIPYRIMIDIN)-4-YL)-
Systematic Name English
Code System Code Type Description
FDA UNII
HM5MDJ6EBL
Created by admin on Sat Dec 16 13:59:15 GMT 2023 , Edited by admin on Sat Dec 16 13:59:15 GMT 2023
PRIMARY
CAS
253688-62-9
Created by admin on Sat Dec 16 13:59:15 GMT 2023 , Edited by admin on Sat Dec 16 13:59:15 GMT 2023
PRIMARY
EPA CompTox
DTXSID401105865
Created by admin on Sat Dec 16 13:59:15 GMT 2023 , Edited by admin on Sat Dec 16 13:59:15 GMT 2023
PRIMARY
PUBCHEM
6426757
Created by admin on Sat Dec 16 13:59:15 GMT 2023 , Edited by admin on Sat Dec 16 13:59:15 GMT 2023
PRIMARY