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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8ClNO3S
Molecular Weight 233.672
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ACETYLSULFANILYL CHLORIDE

SMILES

CC(=O)NC1=CC=C(C=C1)S(Cl)(=O)=O

InChI

InChIKey=GRDXCFKBQWDAJH-UHFFFAOYSA-N
InChI=1S/C8H8ClNO3S/c1-6(11)10-7-2-4-8(5-3-7)14(9,12)13/h2-5H,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C8H8ClNO3S
Molecular Weight 233.672
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

N-Acetylsulfanilyl chloride is a benzenesulfonyl chloride derivative used as intermediate in the synthesis of various pharmaceuticals and organic compounds. N-Acetylsulfanilyl chloride is also used in the synthesis of N,N-dimethylsulfanilamide as the internal standard in the reaction. The reaction is used to determine tramadol and its O-demethylated metabolite in blood plasma.

Approval Year

PubMed

PubMed

TitleDatePubMed
A novel kind of antitumour drugs using sulfonamide as parent compound.
2001 Nov-Dec
Expression of a novel carbonic anhydrase, CA XIII, in normal and neoplastic colorectal mucosa.
2005 Apr 18
The preparation and antioxidant activity of the sulfanilamide derivatives of chitosan and chitosan sulfates.
2007 Jun 1
Synthesis and antifungal properties of sulfanilamide derivatives of chitosan.
2007 Nov 26
3-[4-(Acetamido)-benzene-sulfonamido]-benzoic acid.
2010 Dec 4
2-(4-Acetamido-benzene-sulfonamido)-3-methyl-butanoic acid.
2010 May 8
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 16:39:56 GMT 2023
Edited
by admin
on Fri Dec 15 16:39:56 GMT 2023
Record UNII
LIX4M9AIVM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ACETYLSULFANILYL CHLORIDE
MI  
Systematic Name English
N-ACETYLSULFANILYL CHLORIDE [MI]
Common Name English
BENZENESULFONYL CHLORIDE, 4-(ACETYLAMINO)-
Systematic Name English
NSC-127860
Code English
4-(ACETYLAMINO)BENZENESULFONYL CHLORIDE [HSDB]
Common Name English
ASC
Common Name English
ACETYLAMINOBENZENE SULFONYL CHLORIDE, P-
Common Name English
P-ACETAMIDOBENZENESULFONYL CHLORIDE
Common Name English
4-(ACETYLAMINO)BENZENESULFONYL CHLORIDE
HSDB  
Systematic Name English
ACETANILIDE-P-SULFONYL CHLORIDE
Common Name English
P-ACETAMINOBENZENESULFONYL CHLORIDE
Common Name English
SULFANILYL CHLORIDE, N-ACETYL-
Systematic Name English
Code System Code Type Description
CAS
121-60-8
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY
NSC
127860
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID8026981
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY
MERCK INDEX
m1365
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY Merck Index
PUBCHEM
8481
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY
HSDB
2712
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY
ECHA (EC/EINECS)
204-485-1
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
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DRUG BANK
DB12337
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY
FDA UNII
LIX4M9AIVM
Created by admin on Fri Dec 15 16:39:56 GMT 2023 , Edited by admin on Fri Dec 15 16:39:56 GMT 2023
PRIMARY