CID 65713

Glisolamide

Structural Information

Molecular Formula
C20H26N4O5S
SMILES
CC1=CC(=NO1)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3
InChI
InChI=1S/C20H26N4O5S/c1-14-13-18(23-29-14)19(25)21-12-11-15-7-9-17(10-8-15)30(27,28)24-20(26)22-16-5-3-2-4-6-16/h7-10,13,16H,2-6,11-12H2,1H3,(H,21,25)(H2,22,24,26)
InChIKey
GZKDXUIWCNCNBJ-UHFFFAOYSA-N
Compound name
N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-5-methyl-1,2-oxazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

3414
Patents

434.16238 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.16966 200.0
[M+Na]+ 457.15160 201.7
[M-H]- 433.15510 208.0
[M+NH4]+ 452.19620 207.2
[M+K]+ 473.12554 199.2
[M+H-H2O]+ 417.15964 190.9
[M+HCOO]- 479.16058 214.3
[M+CH3COO]- 493.17623 229.0
[M+Na-2H]- 455.13705 201.0
[M]+ 434.16183 199.6
[M]- 434.16293 199.6
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

patents stripe