CID 5911964

2-{(3z)-3-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1h-indol-1-yl}-n-(2-methylphenyl)acetamide

Structural Information

Molecular Formula
C24H23N3O4S2
SMILES
CC1=CC=CC=C1NC(=O)CN2C3=CC=CC=C3/C(=C/4\C(=O)N(C(=S)S4)CCCOC)/C2=O
InChI
InChI=1S/C24H23N3O4S2/c1-15-8-3-5-10-17(15)25-19(28)14-27-18-11-6-4-9-16(18)20(22(27)29)21-23(30)26(24(32)33-21)12-7-13-31-2/h3-6,8-11H,7,12-14H2,1-2H3,(H,25,28)/b21-20-
InChIKey
GUODJAPOEWKNHQ-MRCUWXFGSA-N
Compound name
2-[(3Z)-3-[3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-2-oxoindol-1-yl]-N-(2-methylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

481.113 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 482.12028 214.5
[M+Na]+ 504.10222 223.8
[M+NH4]+ 499.14682 219.7
[M+K]+ 520.07616 217.1
[M-H]- 480.10572 217.7
[M+Na-2H]- 502.08767 216.7
[M]+ 481.11245 217.3
[M]- 481.11355 217.3
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.