CID 3875844

326916-21-6

Structural Information

Molecular Formula
C16H18ClN3O3S
SMILES
C1COCCN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)Cl)N
InChI
InChI=1S/C16H18ClN3O3S/c17-12-1-3-13(4-2-12)19-24(21,22)14-5-6-16(15(18)11-14)20-7-9-23-10-8-20/h1-6,11,19H,7-10,18H2
InChIKey
OGXVDBQWLYKUQF-UHFFFAOYSA-N
Compound name
3-amino-N-(4-chlorophenyl)-4-morpholin-4-ylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

367.07574 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.08302 182.1
[M+Na]+ 390.06496 188.7
[M-H]- 366.06846 190.3
[M+NH4]+ 385.10956 191.9
[M+K]+ 406.03890 183.4
[M+H-H2O]+ 350.07300 173.7
[M+HCOO]- 412.07394 192.0
[M+CH3COO]- 426.08959 213.5
[M+Na-2H]- 388.05041 185.5
[M]+ 367.07519 181.7
[M]- 367.07629 181.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.