CID 3055039

Benzenesulfonamide, n-(5-(2-(dimethylamino)ethyl)-2-thiazolyl)-4-methyl-, monohydrochloride

Structural Information

Molecular Formula
C14H19N3O2S2
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(S2)CCN(C)C
InChI
InChI=1S/C14H19N3O2S2/c1-11-4-6-13(7-5-11)21(18,19)16-14-15-10-12(20-14)8-9-17(2)3/h4-7,10H,8-9H2,1-3H3,(H,15,16)
InChIKey
NHMYNMWTEXVKMZ-UHFFFAOYSA-N
Compound name
N-[5-[2-(dimethylamino)ethyl]-1,3-thiazol-2-yl]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.09186 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.09914 173.8
[M+Na]+ 348.08108 183.1
[M+NH4]+ 343.12568 180.9
[M+K]+ 364.05502 175.8
[M-H]- 324.08458 177.1
[M+Na-2H]- 346.06653 179.5
[M]+ 325.09131 176.8
[M]- 325.09241 176.8
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.