CID 14014911

92928-62-6

Structural Information

Molecular Formula
C22H25N5S
SMILES
CCN(CC)CCN1C2=CC=CC=C2C(=NNC3=NC=CS3)C4=CC=CC=C41
InChI
InChI=1S/C22H25N5S/c1-3-26(4-2)14-15-27-19-11-7-5-9-17(19)21(18-10-6-8-12-20(18)27)24-25-22-23-13-16-28-22/h5-13,16H,3-4,14-15H2,1-2H3,(H,23,25)
InChIKey
RDVBITKJEGHUMA-UHFFFAOYSA-N
Compound name
N-[[10-[2-(diethylamino)ethyl]acridin-9-ylidene]amino]-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

391.18307 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.19035 190.7
[M+Na]+ 414.17229 199.1
[M-H]- 390.17579 199.3
[M+NH4]+ 409.21689 204.5
[M+K]+ 430.14623 192.5
[M+H-H2O]+ 374.18033 180.5
[M+HCOO]- 436.18127 211.7
[M+CH3COO]- 450.19692 201.1
[M+Na-2H]- 412.15774 196.4
[M]+ 391.18252 197.2
[M]- 391.18362 197.2
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