CID 459119

N-[4-[(6-methyl-1,3-benzothiazol-2-yl)sulfamoyl]phenyl]acetamide

Structural Information

Molecular Formula
C16H15N3O3S2
SMILES
CC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C
InChI
InChI=1S/C16H15N3O3S2/c1-10-3-8-14-15(9-10)23-16(18-14)19-24(21,22)13-6-4-12(5-7-13)17-11(2)20/h3-9H,1-2H3,(H,17,20)(H,18,19)
InChIKey
NKTDWUALJNNLPV-UHFFFAOYSA-N
Compound name
N-[4-[(6-methyl-1,3-benzothiazol-2-yl)sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

0
Patents

361.05548 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.06276 181.0
[M+Na]+ 384.04470 190.8
[M-H]- 360.04820 187.9
[M+NH4]+ 379.08930 195.5
[M+K]+ 400.01864 184.4
[M+H-H2O]+ 344.05274 174.2
[M+HCOO]- 406.05368 195.3
[M+CH3COO]- 420.06933 213.8
[M+Na-2H]- 382.03015 185.1
[M]+ 361.05493 186.4
[M]- 361.05603 186.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.