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Details

Stereochemistry ACHIRAL
Molecular Formula C18H15Cl2NO6S
Molecular Weight 444.286
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-CHLORO-5-((2-CHLORO-4-(METHYLSULFONYL)BENZOYL)AMINO)-.GAMMA.-OXO-BENZENEBUTANOIC ACID

SMILES

CS(=O)(=O)C1=CC=C(C(=O)NC2=CC=C(Cl)C(=C2)C(=O)CCC(O)=O)C(Cl)=C1

InChI

InChIKey=JQBRYJUQRAGUAR-UHFFFAOYSA-N
InChI=1S/C18H15Cl2NO6S/c1-28(26,27)11-3-4-12(15(20)9-11)18(25)21-10-2-5-14(19)13(8-10)16(22)6-7-17(23)24/h2-5,8-9H,6-7H2,1H3,(H,21,25)(H,23,24)

HIDE SMILES / InChI

Molecular Formula C18H15Cl2NO6S
Molecular Weight 444.286
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 Mon Mar 31 22:25:50 GMT 2025
Edited
by admin
on Mon Mar 31 22:25:50 GMT 2025
Record UNII
CBW6F4TDT7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VISMODEGIB (M13)
Preferred Name English
2-CHLORO-5-((2-CHLORO-4-(METHYLSULFONYL)BENZOYL)AMINO)-.GAMMA.-OXO-BENZENEBUTANOIC ACID
Systematic Name English
BENZENEBUTANOIC ACID, 2-CHLORO-5-((2-CHLORO-4-(METHYLSULFONYL)BENZOYL)AMINO)-.GAMMA.-OXO-
Systematic Name English
Code System Code Type Description
FDA UNII
CBW6F4TDT7
Created by admin on Mon Mar 31 22:25:50 GMT 2025 , Edited by admin on Mon Mar 31 22:25:50 GMT 2025
PRIMARY
PUBCHEM
156028048
Created by admin on Mon Mar 31 22:25:50 GMT 2025 , Edited by admin on Mon Mar 31 22:25:50 GMT 2025
PRIMARY
CAS
1370024-39-7
Created by admin on Mon Mar 31 22:25:50 GMT 2025 , Edited by admin on Mon Mar 31 22:25:50 GMT 2025
PRIMARY
Related Record Type Details
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