CID 687455

N-(4-sulfamoylphenyl)thiophene-2-carboxamide

Structural Information

Molecular Formula
C11H10N2O3S2
SMILES
C1=CSC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N
InChI
InChI=1S/C11H10N2O3S2/c12-18(15,16)9-5-3-8(4-6-9)13-11(14)10-2-1-7-17-10/h1-7H,(H,13,14)(H2,12,15,16)
InChIKey
LXJKBJZVOISOOA-UHFFFAOYSA-N
Compound name
N-(4-sulfamoylphenyl)thiophene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2
Patents

282.01328 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.02056 161.5
[M+Na]+ 305.00250 169.4
[M-H]- 281.00600 167.8
[M+NH4]+ 300.04710 178.5
[M+K]+ 320.97644 164.1
[M+H-H2O]+ 265.01054 155.0
[M+HCOO]- 327.01148 176.6
[M+CH3COO]- 341.02713 196.0
[M+Na-2H]- 302.98795 163.4
[M]+ 282.01273 162.4
[M]- 282.01383 162.4
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