CID 6888395

2-(1,3-benzothiazol-2-ylsulfanyl)-n'-[(1e,2e)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]acetohydrazide

Structural Information

Molecular Formula
C17H15N3O2S2
SMILES
C/C(=C\C1=CC=CO1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2
InChI
InChI=1S/C17H15N3O2S2/c1-12(9-13-5-4-8-22-13)10-18-20-16(21)11-23-17-19-14-6-2-3-7-15(14)24-17/h2-10H,11H2,1H3,(H,20,21)/b12-9+,18-10+
InChIKey
GOSHICJFRHPLIL-QLEPDINUSA-N
Compound name
2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-[(E)-3-(furan-2-yl)-2-methylprop-2-enylidene]amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.06058 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.06786 180.3
[M+Na]+ 380.04980 190.2
[M+NH4]+ 375.09440 187.8
[M+K]+ 396.02374 183.3
[M-H]- 356.05330 185.4
[M+Na-2H]- 378.03525 185.4
[M]+ 357.06003 183.9
[M]- 357.06113 183.9
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.