CID 5873005

5448-98-6

Structural Information

Molecular Formula
C17H19N3O4S
SMILES
C/C(=N/NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C)/C2=CC=C(C=C2)OC
InChI
InChI=1S/C17H19N3O4S/c1-12(14-4-8-16(24-3)9-5-14)19-20-25(22,23)17-10-6-15(7-11-17)18-13(2)21/h4-11,20H,1-3H3,(H,18,21)/b19-12-
InChIKey
YASPKPYQUUOCES-UNOMPAQXSA-N
Compound name
N-[4-[[(Z)-1-(4-methoxyphenyl)ethylideneamino]sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.10962 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.11690 182.6
[M+Na]+ 384.09884 187.7
[M-H]- 360.10234 190.3
[M+NH4]+ 379.14344 194.8
[M+K]+ 400.07278 184.4
[M+H-H2O]+ 344.10688 173.5
[M+HCOO]- 406.10782 202.9
[M+CH3COO]- 420.12347 220.7
[M+Na-2H]- 382.08429 186.0
[M]+ 361.10907 186.1
[M]- 361.11017 186.1
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.