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]+ 343.11110 176.7
[M+Na]+ 365.09304 182.3
[M-H]- 341.09654 180.7
[M+NH4]+ 360.13764 188.9
[M+K]+ 381.06698 176.5
[M+H-H2O]+ 325.10108 168.2
[M+HCOO]- 387.10202 189.7
[M+CH3COO]- 401.11767 209.6
[M+Na-2H]- 363.07849 178.9
[M]+ 342.10327 176.7
[M]- 342.10437 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.