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Acetanilide, 4'-(bis(2-chloroethyl)sulfamoyl)-

HCID 28435
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
17262-66-7
Standard SMILES
CC(=O)Nc1ccc(S(=O)(=O)N(CCCl)CCCl)cc1
InChIKey
ZZMBNTSBFXXLIU-UHFFFAOYSA-N
Molecular formula
C12H16Cl2N2O3S
Average molar mass
339.2 g/mol
Monoisotopic mass
338.0258689

Names & identifiers

Preferred name
Acetanilide, 4'-(bis(2-chloroethyl)sulfamoyl)-
IUPAC
N-[4-[bis(2-chloroethyl)sulfamoyl]phenyl]acetamide

Names & synonyms

ACETANILIDE, 4'-(BIS(2-CHLOROETHYL)SULFAMOYL)-17262-66-7DTXSID10169359RefChem:1075471DTXCID5091850BRN 27049444'-(Bis(2-chloroethyl)sulfamoyl)acetanilideN,N-Bis(2-chloroethyl)-4-(acetylamino)benzenesulfonamideN(sub 4)-Acetil-sulfanilil-N(sub 1)-(di-beta-cloroetil) amide [Italian]N-{4-[bis(2-chloroethyl)sulfamoyl]phenyl}acetamideSCHEMBL4075322ZZMBNTSBFXXLIU-UHFFFAOYSA-N
Show more names
N(sub 4)-Acetil-sulfanilil-N(sub 1)-(di-beta-cloroetil) amideAKOS020917965

Database identifiers

CAS
17262-66-7
PubChem CID
28435
DTXSID
DTXSID10169359
Nikkaji
J73.552C

Properties

Computed structural propertiesFilling in

XLogP
1.4
Topological polar surface area
74.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
20
Formal charge
0
Complexity
397

Related reactions

2 records
New reaction record
HRID 1149638 reaction equation
HRID 1149638As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1787987 reaction equation
HRID 1787987As productuspto-grants-2009_03

Compound notes

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