CID 5010173

5-amino-n-(2-chlorophenyl)-2-(morpholin-4-yl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C16H18ClN3O3S
SMILES
C1COCCN1C2=C(C=C(C=C2)N)S(=O)(=O)NC3=CC=CC=C3Cl
InChI
InChI=1S/C16H18ClN3O3S/c17-13-3-1-2-4-14(13)19-24(21,22)16-11-12(18)5-6-15(16)20-7-9-23-10-8-20/h1-6,11,19H,7-10,18H2
InChIKey
OPQBCYUORLCLHU-UHFFFAOYSA-N
Compound name
5-amino-N-(2-chlorophenyl)-2-morpholin-4-ylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

2
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

patents stripe