CID 476182

2,4-diethyl-3,5-bis-(2-methoxy-phenylimino)-[1,2,4]thiadiazolidine

Structural Information

Molecular Formula
C20H24N4O2S
SMILES
CCN1C(=NC2=CC=CC=C2OC)N(SC1=NC3=CC=CC=C3OC)CC
InChI
InChI=1S/C20H24N4O2S/c1-5-23-19(21-15-11-7-9-13-17(15)25-3)24(6-2)27-20(23)22-16-12-8-10-14-18(16)26-4/h7-14H,5-6H2,1-4H3
InChIKey
DBZQCKNODXGXEM-UHFFFAOYSA-N
Compound name
2,4-diethyl-3-N,5-N-bis(2-methoxyphenyl)-1,2,4-thiadiazolidine-3,5-diimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

384.162 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.16928 192.5
[M+Na]+ 407.15122 202.3
[M-H]- 383.15472 203.4
[M+NH4]+ 402.19582 205.3
[M+K]+ 423.12516 196.7
[M+H-H2O]+ 367.15926 182.0
[M+HCOO]- 429.16020 215.1
[M+CH3COO]- 443.17585 226.5
[M+Na-2H]- 405.13667 192.8
[M]+ 384.16145 200.5
[M]- 384.16255 200.5
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

No patent data available for this compound.