CID 6001957

303104-07-6

Structural Information

Molecular Formula
C23H27N5O2
SMILES
CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)C2=C(C(=NN2)C3=CC=C(C=C3)OC)C
InChI
InChI=1S/C23H27N5O2/c1-5-28(6-2)19-11-7-17(8-12-19)15-24-27-23(29)22-16(3)21(25-26-22)18-9-13-20(30-4)14-10-18/h7-15H,5-6H2,1-4H3,(H,25,26)(H,27,29)/b24-15+
InChIKey
RHMQOMALNINHHC-BUVRLJJBSA-N
Compound name
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-(4-methoxyphenyl)-4-methyl-1H-pyrazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.21646 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.22374 201.3
[M+Na]+ 428.20568 212.3
[M+NH4]+ 423.25028 206.4
[M+K]+ 444.17962 207.2
[M-H]- 404.20918 206.9
[M+Na-2H]- 426.19113 208.9
[M]+ 405.21591 204.1
[M]- 405.21701 204.1
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.