CID 6510243

N-(4-(((1-(1-piperidinyl)propylidene)amino)sulfonyl)phenyl)acetamide

Structural Information

Molecular Formula
C16H23N3O3S
SMILES
CC/C(=N/S(=O)(=O)C1=CC=C(C=C1)NC(=O)C)/N2CCCCC2
InChI
InChI=1S/C16H23N3O3S/c1-3-16(19-11-5-4-6-12-19)18-23(21,22)15-9-7-14(8-10-15)17-13(2)20/h7-10H,3-6,11-12H2,1-2H3,(H,17,20)/b18-16-
InChIKey
STQWMMOPBZPTEJ-VLGSPTGOSA-N
Compound name
N-[4-[(Z)-1-piperidin-1-ylpropylideneamino]sulfonylphenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.14603 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.15331 178.0
[M+Na]+ 360.13525 181.1
[M-H]- 336.13875 183.3
[M+NH4]+ 355.17985 190.1
[M+K]+ 376.10919 177.8
[M+H-H2O]+ 320.14329 169.3
[M+HCOO]- 382.14423 192.2
[M+CH3COO]- 396.15988 212.1
[M+Na-2H]- 358.12070 179.3
[M]+ 337.14548 176.6
[M]- 337.14658 176.6
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.