CID 16202507

Dtxsid201343334

Structural Information

Molecular Formula
C14H19ClFN3O5S
SMILES
CCOC(=O)NC1=C(C=C(C(=C1)C(=O)NS(=O)(=O)N(C)C(C)C)Cl)F
InChI
InChI=1S/C14H19ClFN3O5S/c1-5-24-14(21)17-12-6-9(10(15)7-11(12)16)13(20)18-25(22,23)19(4)8(2)3/h6-8H,5H2,1-4H3,(H,17,21)(H,18,20)
InChIKey
RUNGZTOOIRQQTN-UHFFFAOYSA-N
Compound name
ethyl N-[4-chloro-2-fluoro-5-[[methyl(propan-2-yl)sulfamoyl]carbamoyl]phenyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

395.0718 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.07908 184.6
[M+Na]+ 418.06102 190.1
[M+NH4]+ 413.10562 187.5
[M+K]+ 434.03496 186.7
[M-H]- 394.06452 182.4
[M+Na-2H]- 416.04647 185.8
[M]+ 395.07125 184.8
[M]- 395.07235 184.8
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

patents stripe