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Details

Stereochemistry ACHIRAL
Molecular Formula C21H28N2O5S
Molecular Weight 420.522
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(Butylamino)-5-[(butylamino)sulfonyl]-4-phenoxybenzoic acid

SMILES

CCCCNC1=C(OC2=CC=CC=C2)C(=CC(=C1)C(O)=O)S(=O)(=O)NCCCC

InChI

InChIKey=DFNMTPXQLBXADX-UHFFFAOYSA-N
InChI=1S/C21H28N2O5S/c1-3-5-12-22-18-14-16(21(24)25)15-19(29(26,27)23-13-6-4-2)20(18)28-17-10-8-7-9-11-17/h7-11,14-15,22-23H,3-6,12-13H2,1-2H3,(H,24,25)

HIDE SMILES / InChI

Approval Year

Name Type Language
3-(Butylamino)-5-[(butylamino)sulfonyl]-4-phenoxybenzoic acid
Systematic Name English
Benzoic acid, 3-(butylamino)-5-(butylsulfamoyl)-4-phenoxy-
Preferred Name English
Benzoic acid, 3-(butylamino)-5-[(butylamino)sulfonyl]-4-phenoxy-
Systematic Name English
Code System Code Type Description
CAS
28469-01-4
Created by admin on Wed Apr 02 19:16:01 GMT 2025 , Edited by admin on Wed Apr 02 19:16:01 GMT 2025
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FDA UNII
U5UPB5L6SH
Created by admin on Wed Apr 02 19:16:01 GMT 2025 , Edited by admin on Wed Apr 02 19:16:01 GMT 2025
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PUBCHEM
16414021
Created by admin on Wed Apr 02 19:16:01 GMT 2025 , Edited by admin on Wed Apr 02 19:16:01 GMT 2025
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