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]+ 402.111826 193.6
[M+Na]+ 424.093768 201.3
[M-H]- 400.097274 203.9
[M+NH4]+ 419.138373 203.4
[M+K]+ 440.067708 198.3
[M+H-H2O]+ 384.101810 184.9
[M+HCOO]- 446.102751 212.2
[M+CH3COO]- 460.118401 223.2
[M+Na-2H]- 422.079216 195.9
[M]+ 401.10400142 199.8
[M]- 401.10509858 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.