CID 71316609

3-ethyl-2-imine meloxicam

Structural Information

Molecular Formula
C16H17N3O4S2
SMILES
CCN1C=C(SC1=NC(=O)C2=C(C3=CC=CC=C3S(=O)(=O)N2C)O)C
InChI
InChI=1S/C16H17N3O4S2/c1-4-19-9-10(2)24-16(19)17-15(21)13-14(20)11-7-5-6-8-12(11)25(22,23)18(13)3/h5-9,20H,4H2,1-3H3
InChIKey
OMOBKXDGWGHXMU-UHFFFAOYSA-N
Compound name
N-(3-ethyl-5-methyl-1,3-thiazol-2-ylidene)-4-hydroxy-2-methyl-1,1-dioxo-1lambda6,2-benzothiazine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

379.06604 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.07332 181.7
[M+Na]+ 402.05526 193.1
[M-H]- 378.05876 187.4
[M+NH4]+ 397.09986 196.8
[M+K]+ 418.02920 187.2
[M+H-H2O]+ 362.06330 175.8
[M+HCOO]- 424.06424 192.7
[M+CH3COO]- 438.07989 215.8
[M+Na-2H]- 400.04071 182.3
[M]+ 379.06549 188.4
[M]- 379.06659 188.4
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

patents stripe