CID 2899877

6486-53-9

Structural Information

Molecular Formula
C23H24N2O4S
SMILES
CC1=CC(=CC=C1)N(CC(=O)NC2=C(C=CC(=C2)C)OC)S(=O)(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H24N2O4S/c1-17-8-7-9-19(14-17)25(30(27,28)20-10-5-4-6-11-20)16-23(26)24-21-15-18(2)12-13-22(21)29-3/h4-15H,16H2,1-3H3,(H,24,26)
InChIKey
MIXJDBGJNZNUPN-UHFFFAOYSA-N
Compound name
2-[N-(benzenesulfonyl)-3-methylanilino]-N-(2-methoxy-5-methylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

424.1457 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.152976 201.0
[M+Na]+ 447.134918 206.2
[M-H]- 423.138424 211.7
[M+NH4]+ 442.179523 210.7
[M+K]+ 463.108858 202.2
[M+H-H2O]+ 407.142960 190.8
[M+HCOO]- 469.143901 219.6
[M+CH3COO]- 483.159551 231.8
[M+Na-2H]- 445.120366 203.0
[M]+ 424.14515142 205.9
[M]- 424.14624858 205.9
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.