CID 2887918

309928-51-6

Structural Information

Molecular Formula
C22H21ClN2O3S
SMILES
CS(=O)(=O)N(CC(CN1C2=CC=CC=C2C3=CC=CC=C31)O)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C22H21ClN2O3S/c1-29(27,28)25(17-12-10-16(23)11-13-17)15-18(26)14-24-21-8-4-2-6-19(21)20-7-3-5-9-22(20)24/h2-13,18,26H,14-15H2,1H3
InChIKey
PGNOCVUAZQJJQH-UHFFFAOYSA-N
Compound name
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-(4-chlorophenyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

428.09613 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.10341 197.8
[M+Na]+ 451.08535 212.2
[M+NH4]+ 446.12995 205.8
[M+K]+ 467.05929 204.1
[M-H]- 427.08885 202.1
[M+Na-2H]- 449.07080 205.2
[M]+ 428.09558 202.0
[M]- 428.09668 202.0
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