CID 11820782

N-[(z)-[3-isopropyl-4-(p-tolyl)thiazol-2-ylidene]amino]-2-pyrazin-2-yloxy-acetamide

Structural Information

Molecular Formula
C19H21N5O2S
SMILES
CC1=CC=C(C=C1)C2=CS/C(=N\NC(=O)COC3=NC=CN=C3)/N2C(C)C
InChI
InChI=1S/C19H21N5O2S/c1-13(2)24-16(15-6-4-14(3)5-7-15)12-27-19(24)23-22-17(25)11-26-18-10-20-8-9-21-18/h4-10,12-13H,11H2,1-3H3,(H,22,25)/b23-19-
InChIKey
VHSIPMVULDUSDZ-NMWGTECJSA-N
Compound name
N-[(Z)-[4-(4-methylphenyl)-3-propan-2-yl-1,3-thiazol-2-ylidene]amino]-2-pyrazin-2-yloxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

383.1416 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.14888 190.2
[M+Na]+ 406.13082 197.6
[M-H]- 382.13432 198.1
[M+NH4]+ 401.17542 200.1
[M+K]+ 422.10476 192.3
[M+H-H2O]+ 366.13886 179.5
[M+HCOO]- 428.13980 208.4
[M+CH3COO]- 442.15545 223.1
[M+Na-2H]- 404.11627 190.5
[M]+ 383.14105 194.7
[M]- 383.14215 194.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.