CID 3071453

1h-imidazole-4-sulfonamide, 1-methyl-n-((4-(4-morpholinylmethyl)phenyl)methyl)-, monohydrochloride

Structural Information

Molecular Formula
C16H22N4O3S
SMILES
CN1C=C(N=C1)S(=O)(=O)NCC2=CC=C(C=C2)CN3CCOCC3
InChI
InChI=1S/C16H22N4O3S/c1-19-12-16(17-13-19)24(21,22)18-10-14-2-4-15(5-3-14)11-20-6-8-23-9-7-20/h2-5,12-13,18H,6-11H2,1H3
InChIKey
GNMDWHHRMAOIQE-UHFFFAOYSA-N
Compound name
1-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]imidazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

350.14127 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.14855 179.5
[M+Na]+ 373.13049 190.1
[M+NH4]+ 368.17509 185.2
[M+K]+ 389.10443 185.0
[M-H]- 349.13399 183.6
[M+Na-2H]- 371.11594 185.5
[M]+ 350.14072 182.4
[M]- 350.14182 182.4
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