CID 3068068

5-thiazolecarboxamide, 4-methyl-n-propyl-2-(3,4,5-trimethoxyphenyl)-

Structural Information

Molecular Formula
C17H22N2O4S
SMILES
CCCNC(=O)C1=C(N=C(S1)C2=CC(=C(C(=C2)OC)OC)OC)C
InChI
InChI=1S/C17H22N2O4S/c1-6-7-18-16(20)15-10(2)19-17(24-15)11-8-12(21-3)14(23-5)13(9-11)22-4/h8-9H,6-7H2,1-5H3,(H,18,20)
InChIKey
QCDDOTXBQFZCPU-UHFFFAOYSA-N
Compound name
4-methyl-N-propyl-2-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

350.13004 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.13732 184.1
[M+Na]+ 373.11926 194.7
[M+NH4]+ 368.16386 190.0
[M+K]+ 389.09320 189.0
[M-H]- 349.12276 186.4
[M+Na-2H]- 371.10471 188.1
[M]+ 350.12949 186.5
[M]- 350.13059 186.5
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

patents stripe