CID 385766

Nsc677160

Structural Information

Molecular Formula
C20H16N4O3S
SMILES
C1=CC=C2C(=C1)C(=C3C=C(C=CC3=N2)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N)N
InChI
InChI=1S/C20H16N4O3S/c21-19-15-3-1-2-4-17(15)24-18-10-5-12(11-16(18)19)20(25)23-13-6-8-14(9-7-13)28(22,26)27/h1-11H,(H2,21,24)(H,23,25)(H2,22,26,27)
InChIKey
AWJKPCXZDCPSTM-UHFFFAOYSA-N
Compound name
9-amino-N-(4-sulfamoylphenyl)acridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

392.0943 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.10158 187.3
[M+Na]+ 415.08352 196.3
[M-H]- 391.08702 193.9
[M+NH4]+ 410.12812 198.1
[M+K]+ 431.05746 189.7
[M+H-H2O]+ 375.09156 178.5
[M+HCOO]- 437.09250 204.2
[M+CH3COO]- 451.10815 196.8
[M+Na-2H]- 413.06897 195.3
[M]+ 392.09375 188.8
[M]- 392.09485 188.8
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.