CID 3025601

N-2-benzothiazolyl-n'-(2-(diethylamino)ethyl)ethanediamide

Structural Information

Molecular Formula
C15H20N4O2S
SMILES
CCN(CC)CCNC(=O)C(=O)NC1=NC2=CC=CC=C2S1
InChI
InChI=1S/C15H20N4O2S/c1-3-19(4-2)10-9-16-13(20)14(21)18-15-17-11-7-5-6-8-12(11)22-15/h5-8H,3-4,9-10H2,1-2H3,(H,16,20)(H,17,18,21)
InChIKey
BYPBQSMJAZZOOD-UHFFFAOYSA-N
Compound name
N'-(1,3-benzothiazol-2-yl)-N-[2-(diethylamino)ethyl]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.1307 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.13798 173.8
[M+Na]+ 343.11992 181.5
[M+NH4]+ 338.16452 180.1
[M+K]+ 359.09386 176.3
[M-H]- 319.12342 175.7
[M+Na-2H]- 341.10537 177.8
[M]+ 320.13015 175.4
[M]- 320.13125 175.4
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.