CID 1271553

183999-58-8

Structural Information

Molecular Formula
C16H12N4O2S2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN4C(=N3)SC(=N4)S(=O)(=O)N
InChI
InChI=1S/C16H12N4O2S2/c17-24(21,22)16-19-20-10-14(18-15(20)23-16)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-10H,(H2,17,21,22)
InChIKey
PJHLUDLULHBJEH-UHFFFAOYSA-N
Compound name
6-(4-phenylphenyl)imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

356.04016 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.04744 180.5
[M+Na]+ 379.02938 194.1
[M-H]- 355.03288 189.2
[M+NH4]+ 374.07398 195.0
[M+K]+ 395.00332 187.1
[M+H-H2O]+ 339.03742 174.4
[M+HCOO]- 401.03836 194.6
[M+CH3COO]- 415.05401 192.3
[M+Na-2H]- 377.01483 182.6
[M]+ 356.03961 185.7
[M]- 356.04071 185.7
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

patents stripe