CID 978533

302950-24-9

Structural Information

Molecular Formula
C19H19N3O5S
SMILES
CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)OC
InChI
InChI=1S/C19H19N3O5S/c1-12-13(2)21-27-19(12)22-28(24,25)17-9-7-15(8-10-17)20-18(23)14-5-4-6-16(11-14)26-3/h4-11,22H,1-3H3,(H,20,23)
InChIKey
QGJMEBLBQUXRJV-UHFFFAOYSA-N
Compound name
N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-3-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

401.10455 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 402.11183 193.6
[M+Na]+ 424.09377 201.3
[M-H]- 400.09727 203.9
[M+NH4]+ 419.13837 203.4
[M+K]+ 440.06771 198.3
[M+H-H2O]+ 384.10181 184.9
[M+HCOO]- 446.10275 212.2
[M+CH3COO]- 460.11840 223.2
[M+Na-2H]- 422.07922 195.9
[M]+ 401.10400 199.8
[M]- 401.10510 199.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.