CID 9619183

N'-(1-(4-ethoxyphenyl)ethylidene)3-(5-me-2-thienyl)-1h-pyrazole-5-carbohydrazide

Structural Information

Molecular Formula
C19H20N4O2S
SMILES
CCOC1=CC=C(C=C1)/C(=N/NC(=O)C2=NNC(=C2)C3=CC=C(S3)C)/C
InChI
InChI=1S/C19H20N4O2S/c1-4-25-15-8-6-14(7-9-15)13(3)20-23-19(24)17-11-16(21-22-17)18-10-5-12(2)26-18/h5-11H,4H2,1-3H3,(H,21,22)(H,23,24)/b20-13+
InChIKey
DTDPRZIEDKSDBW-DEDYPNTBSA-N
Compound name
N-[(E)-1-(4-ethoxyphenyl)ethylideneamino]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.1307 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.137976 187.4
[M+Na]+ 391.119918 195.3
[M-H]- 367.123424 196.3
[M+NH4]+ 386.164523 200.8
[M+K]+ 407.093858 190.1
[M+H-H2O]+ 351.127960 178.6
[M+HCOO]- 413.128901 207.9
[M+CH3COO]- 427.144551 217.6
[M+Na-2H]- 389.105366 185.5
[M]+ 368.13015142 192.3
[M]- 368.13124858 192.3
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.