CID 3048175

D 225

Structural Information

Molecular Formula
C19H24N4OS
SMILES
CCN(CC)CCCNC(=O)N1C2=CC=CC=C2SC3=C1N=CC=C3
InChI
InChI=1S/C19H24N4OS/c1-3-22(4-2)14-8-13-21-19(24)23-15-9-5-6-10-16(15)25-17-11-7-12-20-18(17)23/h5-7,9-12H,3-4,8,13-14H2,1-2H3,(H,21,24)
InChIKey
YDYWWRFRRKMBAA-UHFFFAOYSA-N
Compound name
N-[3-(diethylamino)propyl]pyrido[3,2-b][1,4]benzothiazine-10-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.16708 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.17436 182.4
[M+Na]+ 379.15630 193.9
[M+NH4]+ 374.20090 190.4
[M+K]+ 395.13024 184.2
[M-H]- 355.15980 186.0
[M+Na-2H]- 377.14175 187.8
[M]+ 356.16653 185.4
[M]- 356.16763 185.4
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.