CID 6447125

71933-33-0

Structural Information

Molecular Formula
C17H24N4O3S2
SMILES
CCN(CC)C/C=C/1\CN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C
InChI
InChI=1S/C17H24N4O3S2/c1-4-21(5-2)11-10-15-12-18-17(25-15)20-26(23,24)16-8-6-14(7-9-16)19-13(3)22/h6-10H,4-5,11-12H2,1-3H3,(H,18,20)(H,19,22)/b15-10+
InChIKey
SFIFASQLDKUJOB-XNTDXEJSSA-N
Compound name
N-[4-[[(5E)-5-[2-(diethylamino)ethylidene]-4H-1,3-thiazol-2-yl]sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.129 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.13628 193.2
[M+Na]+ 419.11822 197.5
[M-H]- 395.12172 198.8
[M+NH4]+ 414.16282 205.0
[M+K]+ 435.09216 192.3
[M+H-H2O]+ 379.12626 184.8
[M+HCOO]- 441.12720 205.8
[M+CH3COO]- 455.14285 224.4
[M+Na-2H]- 417.10367 192.6
[M]+ 396.12845 196.1
[M]- 396.12955 196.1
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.