CID 3063283

Brn 0294170

Structural Information

Molecular Formula
C8H10N4O2S3
SMILES
CC1=C(SC(=N1)N)S(=O)(=O)C2=C(N=C(S2)N)C
InChI
InChI=1S/C8H10N4O2S3/c1-3-5(15-7(9)11-3)17(13,14)6-4(2)12-8(10)16-6/h1-2H3,(H2,9,11)(H2,10,12)
InChIKey
ZGFSBSDMNFMDSD-UHFFFAOYSA-N
Compound name
5-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfonyl]-4-methyl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.99658 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.00386 161.9
[M+Na]+ 312.98580 175.0
[M-H]- 288.98930 166.5
[M+NH4]+ 308.03040 178.7
[M+K]+ 328.95974 167.7
[M+H-H2O]+ 272.99384 156.7
[M+HCOO]- 334.99478 171.8
[M+CH3COO]- 349.01043 199.3
[M+Na-2H]- 310.97125 160.5
[M]+ 289.99603 164.7
[M]- 289.99713 164.7
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.