CID 6435573

N-(5-butylidene-2-(2-methoxyphenyl)-4-oxo-3-thiazolidinyl)-2-hydroxybenzamide

Structural Information

Molecular Formula
C21H22N2O4S
SMILES
CCC/C=C\1/C(=O)N(C(S1)C2=CC=CC=C2OC)NC(=O)C3=CC=CC=C3O
InChI
InChI=1S/C21H22N2O4S/c1-3-4-13-18-20(26)23(22-19(25)14-9-5-7-11-16(14)24)21(28-18)15-10-6-8-12-17(15)27-2/h5-13,21,24H,3-4H2,1-2H3,(H,22,25)/b18-13-
InChIKey
ZQOJTDMPWAIMHP-AQTBWJFISA-N
Compound name
N-[(5Z)-5-butylidene-2-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.13004 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.13732 195.6
[M+Na]+ 421.11926 206.2
[M+NH4]+ 416.16386 201.2
[M+K]+ 437.09320 199.7
[M-H]- 397.12276 199.4
[M+Na-2H]- 419.10471 200.6
[M]+ 398.12949 198.3
[M]- 398.13059 198.3
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.