CID 6871209

2-(1,3-benzothiazol-2-ylsulfanyl)-n'-[(e)-(4-methoxyphenyl)methylidene]acetohydrazide

Structural Information

Molecular Formula
C17H15N3O2S2
SMILES
COC1=CC=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3S2
InChI
InChI=1S/C17H15N3O2S2/c1-22-13-8-6-12(7-9-13)10-18-20-16(21)11-23-17-19-14-4-2-3-5-15(14)24-17/h2-10H,11H2,1H3,(H,20,21)/b18-10+
InChIKey
ZHWOZHUDZLEPIT-VCHYOVAHSA-N
Compound name
2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(4-methoxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.06058 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.06786 177.4
[M+Na]+ 380.04980 189.5
[M+NH4]+ 375.09440 185.7
[M+K]+ 396.02374 179.6
[M-H]- 356.05330 182.6
[M+Na-2H]- 378.03525 185.1
[M]+ 357.06003 181.5
[M]- 357.06113 181.5
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.