CID 3049369

Brn 1156554

Structural Information

Molecular Formula
C16H14N4OS2
SMILES
C1=CC=C(C=C1)NNC(=O)C2=C(N(C(=S)S2)C3=CC=CC=C3)N
InChI
InChI=1S/C16H14N4OS2/c17-14-13(15(21)19-18-11-7-3-1-4-8-11)23-16(22)20(14)12-9-5-2-6-10-12/h1-10,18H,17H2,(H,19,21)
InChIKey
ADQMXLVAJQXFLM-UHFFFAOYSA-N
Compound name
4-amino-N',3-diphenyl-2-sulfanylidene-1,3-thiazole-5-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.0609 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.06818 172.5
[M+Na]+ 365.05012 183.6
[M+NH4]+ 360.09472 180.4
[M+K]+ 381.02406 175.1
[M-H]- 341.05362 179.3
[M+Na-2H]- 363.03557 181.3
[M]+ 342.06035 176.7
[M]- 342.06145 176.7
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.