CID 27115

Benzamide, m-amino-n-antipyrinyl-n-ethyl-

Structural Information

Molecular Formula
C20H22N4O2
SMILES
CCN(C1=C(N(N(C1=O)C2=CC=CC=C2)C)C)C(=O)C3=CC(=CC=C3)N
InChI
InChI=1S/C20H22N4O2/c1-4-23(19(25)15-9-8-10-16(21)13-15)18-14(2)22(3)24(20(18)26)17-11-6-5-7-12-17/h5-13H,4,21H2,1-3H3
InChIKey
KAGVBQLLHQIJRM-UHFFFAOYSA-N
Compound name
3-amino-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-ethylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.1743 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.18158 184.8
[M+Na]+ 373.16352 197.9
[M+NH4]+ 368.20812 190.9
[M+K]+ 389.13746 193.5
[M-H]- 349.16702 190.2
[M+Na-2H]- 371.14897 192.8
[M]+ 350.17375 188.1
[M]- 350.17485 188.1
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.