CID 16637117

2-({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetohydrazide

Structural Information

Molecular Formula
C15H14N4OS3
SMILES
C1=CC=C2C(=C1)C=CC=C2CSC3=NN=C(S3)SCC(=O)NN
InChI
InChI=1S/C15H14N4OS3/c16-17-13(20)9-22-15-19-18-14(23-15)21-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8-9,16H2,(H,17,20)
InChIKey
WMQQYXXTWQIFLZ-UHFFFAOYSA-N
Compound name
2-[[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.033 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.04028 169.9
[M+Na]+ 385.02222 181.0
[M+NH4]+ 380.06682 178.1
[M+K]+ 400.99616 170.7
[M-H]- 361.02572 174.5
[M+Na-2H]- 383.00767 176.4
[M]+ 362.03245 174.0
[M]- 362.03355 174.0
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.