CID 3043794

Formamide, n-((4-((3-(trifluoromethyl)phenyl)amino)-3-pyridinyl)sulfonyl)-

Structural Information

Molecular Formula
C13H10F3N3O3S
SMILES
C1=CC(=CC(=C1)NC2=C(C=NC=C2)S(=O)(=O)NC=O)C(F)(F)F
InChI
InChI=1S/C13H10F3N3O3S/c14-13(15,16)9-2-1-3-10(6-9)19-11-4-5-17-7-12(11)23(21,22)18-8-20/h1-8H,(H,17,19)(H,18,20)
InChIKey
AXRGGQNXQBMABA-UHFFFAOYSA-N
Compound name
N-[4-[3-(trifluoromethyl)anilino]pyridin-3-yl]sulfonylformamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.0395 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.04678 171.5
[M+Na]+ 368.02872 179.1
[M+NH4]+ 363.07332 174.8
[M+K]+ 384.00266 173.6
[M-H]- 344.03222 169.1
[M+Na-2H]- 366.01417 176.6
[M]+ 345.03895 171.9
[M]- 345.04005 171.9
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.