CID 3254740

3-amino-n,n-diethyl-4-[(2-methoxyphenyl)amino]benzene-1-sulfonamide

Structural Information

Molecular Formula
C17H23N3O3S
SMILES
CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC=C2OC)N
InChI
InChI=1S/C17H23N3O3S/c1-4-20(5-2)24(21,22)13-10-11-15(14(18)12-13)19-16-8-6-7-9-17(16)23-3/h6-12,19H,4-5,18H2,1-3H3
InChIKey
UNEBVKXIXLVESW-UHFFFAOYSA-N
Compound name
3-amino-N,N-diethyl-4-(2-methoxyanilino)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.14603 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.15331 180.9
[M+Na]+ 372.13525 186.8
[M-H]- 348.13875 188.4
[M+NH4]+ 367.17985 193.9
[M+K]+ 388.10919 183.2
[M+H-H2O]+ 332.14329 172.0
[M+HCOO]- 394.14423 201.0
[M+CH3COO]- 408.15988 221.2
[M+Na-2H]- 370.12070 183.5
[M]+ 349.14548 184.6
[M]- 349.14658 184.6
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.