CID 3055034

71933-41-0

Structural Information

Molecular Formula
C15H22N4O2S2
SMILES
CCN(CC)CCC1=CN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C15H22N4O2S2/c1-3-19(4-2)10-9-13-11-17-15(22-13)18-23(20,21)14-7-5-12(16)6-8-14/h5-8,11H,3-4,9-10,16H2,1-2H3,(H,17,18)
InChIKey
IFCJACHSHHEHIX-UHFFFAOYSA-N
Compound name
4-amino-N-[5-[2-(diethylamino)ethyl]-1,3-thiazol-2-yl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.1184 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.125676 180.5
[M+Na]+ 377.107618 186.8
[M-H]- 353.111124 186.3
[M+NH4]+ 372.152223 194.1
[M+K]+ 393.081558 181.4
[M+H-H2O]+ 337.115660 172.2
[M+HCOO]- 399.116601 195.1
[M+CH3COO]- 413.132251 218.3
[M+Na-2H]- 375.093066 181.3
[M]+ 354.11785142 183.9
[M]- 354.11894858 183.9
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.