CID 218371

Brn 0723604

Structural Information

Molecular Formula
C20H19N5O4
SMILES
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3NC(=O)C(=O)N
InChI
InChI=1S/C20H19N5O4/c1-12-16(20(29)25(24(12)2)13-8-4-3-5-9-13)23-18(27)14-10-6-7-11-15(14)22-19(28)17(21)26/h3-11H,1-2H3,(H2,21,26)(H,22,28)(H,23,27)
InChIKey
MGKAUOZEHLOQQX-UHFFFAOYSA-N
Compound name
N'-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

393.1437 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.15098 192.3
[M+Na]+ 416.13292 202.1
[M+NH4]+ 411.17752 195.5
[M+K]+ 432.10686 200.4
[M-H]- 392.13642 195.7
[M+Na-2H]- 414.11837 198.0
[M]+ 393.14315 194.0
[M]- 393.14425 194.0
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.