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N-(2-Acetyl-3-thienyl)-4-chlorobenzenesulfonamide

HCID 2807744
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Basic information

CAS
676120-27-7
Standard SMILES
CC(=O)c1sccc1NS(=O)(=O)c1ccc(Cl)cc1
InChIKey
VTLUNVUQQGVBGM-UHFFFAOYSA-N
Molecular formula
C12H10ClNO3S2
Average molar mass
315.8 g/mol
Monoisotopic mass
314.9790632

Names & identifiers

Preferred name
N-(2-Acetyl-3-thienyl)-4-chlorobenzenesulfonamide
IUPAC
N-(2-acetylthiophen-3-yl)-4-chlorobenzenesulfonamide

Names & synonyms

N-(2-Acetyl-3-thienyl)-4-chlorobenzenesulfonamideDTXSID501231744676120-27-7N-(2-Acetylthiophen-3-yl)-4-chlorobenzene-1-sulfonamide

Database identifiers

CAS
676120-27-7
PubChem CID
2807744
DTXSID
DTXSID501231744

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
99.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
427

Related reactions

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