CID 3118838

308095-59-2

Structural Information

Molecular Formula
C19H19N3O3S
SMILES
CC1=CC=C(C=C1)N(CC(=O)N)C2C(=O)N(C(=O)S2)C3=CC=CC(=C3)C
InChI
InChI=1S/C19H19N3O3S/c1-12-6-8-14(9-7-12)21(11-16(20)23)18-17(24)22(19(25)26-18)15-5-3-4-13(2)10-15/h3-10,18H,11H2,1-2H3,(H2,20,23)
InChIKey
WCMCMAMJWUQJSI-UHFFFAOYSA-N
Compound name
2-(4-methyl-N-[3-(3-methylphenyl)-2,4-dioxo-1,3-thiazolidin-5-yl]anilino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.11472 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.12200 186.4
[M+Na]+ 392.10394 197.0
[M+NH4]+ 387.14854 192.8
[M+K]+ 408.07788 191.4
[M-H]- 368.10744 191.6
[M+Na-2H]- 390.08939 192.5
[M]+ 369.11417 189.5
[M]- 369.11527 189.5
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.