CID 11375216

Schembl12167789

Structural Information

Molecular Formula
C27H24N2O5S
SMILES
COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4
InChI
InChI=1S/C27H24N2O5S/c1-33-23-15-17-26(18-16-23)35(31,32)29-22-9-13-25(14-10-22)34-24-11-7-21(8-12-24)28-27(30)19-20-5-3-2-4-6-20/h2-18,29H,19H2,1H3,(H,28,30)
InChIKey
DCYMPHHUACFVPJ-UHFFFAOYSA-N
Compound name
N-[4-[4-[(4-methoxyphenyl)sulfonylamino]phenoxy]phenyl]-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

488.1406 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 489.14788 215.4
[M+Na]+ 511.12982 219.5
[M-H]- 487.13332 227.1
[M+NH4]+ 506.17442 220.9
[M+K]+ 527.10376 214.1
[M+H-H2O]+ 471.13786 203.7
[M+HCOO]- 533.13880 233.4
[M+CH3COO]- 547.15445 238.8
[M+Na-2H]- 509.11527 219.1
[M]+ 488.14005 218.7
[M]- 488.14115 218.7
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