CID 2139129

2-[(3z)-3-(3-isopropyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1h-indol-1-yl]-n-(2-phenylethyl)acetamide

Structural Information

Molecular Formula
C24H23N3O3S2
SMILES
CC(C)N1C(=O)/C(=C/2\C3=CC=CC=C3N(C2=O)CC(=O)NCCC4=CC=CC=C4)/SC1=S
InChI
InChI=1S/C24H23N3O3S2/c1-15(2)27-23(30)21(32-24(27)31)20-17-10-6-7-11-18(17)26(22(20)29)14-19(28)25-13-12-16-8-4-3-5-9-16/h3-11,15H,12-14H2,1-2H3,(H,25,28)/b21-20-
InChIKey
UJSLRYHNNSESQT-MRCUWXFGSA-N
Compound name
2-[(3Z)-2-oxo-3-(4-oxo-3-propan-2-yl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)indol-1-yl]-N-(2-phenylethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

465.11807 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 466.12535 209.4
[M+Na]+ 488.10729 218.5
[M+NH4]+ 483.15189 215.0
[M+K]+ 504.08123 211.9
[M-H]- 464.11079 212.8
[M+Na-2H]- 486.09274 212.1
[M]+ 465.11752 212.2
[M]- 465.11862 212.2
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.