CID 367741

N-(2-ethoxyphenyl)-2-(3-oxo-3,4-dihydro-2h-1,4-benzothiazin-2-yl)acetamide

Structural Information

Molecular Formula
C18H18N2O3S
SMILES
CCOC1=CC=CC=C1NC(=O)CC2C(=O)NC3=CC=CC=C3S2
InChI
InChI=1S/C18H18N2O3S/c1-2-23-14-9-5-3-7-12(14)19-17(21)11-16-18(22)20-13-8-4-6-10-15(13)24-16/h3-10,16H,2,11H2,1H3,(H,19,21)(H,20,22)
InChIKey
MBOSLJJAFXHOQG-UHFFFAOYSA-N
Compound name
N-(2-ethoxyphenyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.10382 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.111096 176.7
[M+Na]+ 365.093038 182.3
[M-H]- 341.096544 180.7
[M+NH4]+ 360.137643 188.9
[M+K]+ 381.066978 176.5
[M+H-H2O]+ 325.101080 168.2
[M+HCOO]- 387.102021 189.7
[M+CH3COO]- 401.117671 209.6
[M+Na-2H]- 363.078486 178.9
[M]+ 342.10327142 176.7
[M]- 342.10436858 176.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.