CID 721139

104246-27-7

Structural Information

Molecular Formula

C₁₁H₁₀ClN₃O₃S₂

SMILES

C1=CC(=CC=C1NC(=O)CCl)S(=O)(=O)NC2=NC=CS2

InChI

InChI=1S/C11H10ClN3O3S2/c12-7-10(16)14-8-1-3-9(4-2-8)20(17,18)15-11-13-5-6-19-11/h1-6H,7H2,(H,13,15)(H,14,16)

InChIKey

NSUHLTKMBRDPDN-UHFFFAOYSA-N

Compound name

2-chloro-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 24
Patents: 330.9852 Da
Monoisotopic Mass: 0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	331.99248	170.6
[M+Na]+	353.97442	179.9
[M+NH4]+	349.01902	177.2
[M+K]+	369.94836	172.9
[M-H]-	329.97792	172.6
[M+Na-2H]-	351.95987	176.1
[M]+	330.98465	173.4
[M]-	330.98575	173.4

Literature stripe

literature stripe

Patent stripe

patents stripe