CID 3074420

2-(5-methyl-2-thienyl)-3-(2-(((5-methyl-2-thienyl)methylene)amino)ethyl)-4-thiazolidinone

Structural Information

Molecular Formula
C16H18N2OS3
SMILES
CC1=CC=C(S1)C=NCCN2C(SCC2=O)C3=CC=C(S3)C
InChI
InChI=1S/C16H18N2OS3/c1-11-3-5-13(21-11)9-17-7-8-18-15(19)10-20-16(18)14-6-4-12(2)22-14/h3-6,9,16H,7-8,10H2,1-2H3
InChIKey
FAYYVBMZPFGIGF-UHFFFAOYSA-N
Compound name
2-(5-methylthiophen-2-yl)-3-[2-[(5-methylthiophen-2-yl)methylideneamino]ethyl]-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.05814 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.06542 179.7
[M+Na]+ 373.04736 189.3
[M+NH4]+ 368.09196 188.5
[M+K]+ 389.02130 181.4
[M-H]- 349.05086 185.1
[M+Na-2H]- 371.03281 183.9
[M]+ 350.05759 183.9
[M]- 350.05869 183.9
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.