CID 129211

Tamsulosin

Structural Information

Molecular Formula
C20H28N2O5S
SMILES
CCOC1=CC=CC=C1OCCN[C@H](C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N
InChI
InChI=1S/C20H28N2O5S/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24)/t15-/m1/s1
InChIKey
DRHKJLXJIQTDTD-OAHLLOKOSA-N
Compound name
5-[(2R)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

2017
References

31063
Patents

408.1719 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.17918 196.2
[M+Na]+ 431.16112 200.6
[M-H]- 407.16462 201.7
[M+NH4]+ 426.20572 206.1
[M+K]+ 447.13506 196.9
[M+H-H2O]+ 391.16916 186.9
[M+HCOO]- 453.17010 213.3
[M+CH3COO]- 467.18575 226.9
[M+Na-2H]- 429.14657 196.9
[M]+ 408.17135 202.6
[M]- 408.17245 202.6
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.