CID 366864

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

Structural Information

Molecular Formula
C18H18N2O3S
SMILES
CCOC1=CC=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3S2
InChI
InChI=1S/C18H18N2O3S/c1-2-23-13-9-7-12(8-10-13)19-17(21)11-16-18(22)20-14-5-3-4-6-15(14)24-16/h3-10,16H,2,11H2,1H3,(H,19,21)(H,20,22)
InChIKey
XIVBMYDTNXTQBA-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2
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

literature stripe

Patent stripe

patents stripe