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Details

Stereochemistry ACHIRAL
Molecular Formula C23H28N3O4S2.Na
Molecular Weight 497.606
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Buloxibutid sodium

SMILES

[Na+].CCCCOC(=O)[N-]S(=O)(=O)C1=C(C=C(CC(C)C)S1)C2=CC=C(CN3C=CN=C3)C=C2

InChI

InChIKey=ZUHAJKQDALIGJV-UHFFFAOYSA-M
InChI=1S/C23H29N3O4S2.Na/c1-4-5-12-30-23(27)25-32(28,29)22-21(14-20(31-22)13-17(2)3)19-8-6-18(7-9-19)15-26-11-10-24-16-26;/h6-11,14,16-17H,4-5,12-13,15H2,1-3H3,(H,25,27);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C23H29N3O4S2
Molecular Weight 475.624
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 13:27:27 UTC 2023
Edited
by admin
on Sat Dec 16 13:27:27 UTC 2023
Record UNII
Y151F1Q61I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Buloxibutid sodium
Common Name English
BUTYL (3-(4-((1H-IMIDAZOL-1-YL)METHYL)PHENYL)-5-ISOBUTYLTHIOPHEN-2-YL)SULFONYLCARBAMATE SODIUM SALT
Systematic Name English
C21 SODIUM
Code English
C-21 SODIUM
Code English
3-(4-(1H-IMIDAZOL-1-YLMETHYL)PHENYL)-5-(2-METHYLPROPYL)THIOPHENE-2-((N-BUTYLOXYLCARBAMATE)-SULPHONAMIDE) SODIUM SALT
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 550816
Created by admin on Sat Dec 16 13:27:27 UTC 2023 , Edited by admin on Sat Dec 16 13:27:27 UTC 2023
Code System Code Type Description
FDA UNII
Y151F1Q61I
Created by admin on Sat Dec 16 13:27:27 UTC 2023 , Edited by admin on Sat Dec 16 13:27:27 UTC 2023
PRIMARY
PUBCHEM
126961847
Created by admin on Sat Dec 16 13:27:27 UTC 2023 , Edited by admin on Sat Dec 16 13:27:27 UTC 2023
PRIMARY
SMS_ID
300000001701
Created by admin on Sat Dec 16 13:27:27 UTC 2023 , Edited by admin on Sat Dec 16 13:27:27 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY