CID 2560328

N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-n-methylmethanesulfonamide

Structural Information

Molecular Formula
C11H13N3O2S2
SMILES
CN(C1=CC=C(C=C1)C2=CSC(=N2)N)S(=O)(=O)C
InChI
InChI=1S/C11H13N3O2S2/c1-14(18(2,15)16)9-5-3-8(4-6-9)10-7-17-11(12)13-10/h3-7H,1-2H3,(H2,12,13)
InChIKey
YIXKIEAVBDBFMZ-UHFFFAOYSA-N
Compound name
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]-N-methylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.04492 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.05220 161.7
[M+Na]+ 306.03414 171.0
[M-H]- 282.03764 168.6
[M+NH4]+ 301.07874 178.7
[M+K]+ 322.00808 166.5
[M+H-H2O]+ 266.04218 154.7
[M+HCOO]- 328.04312 176.7
[M+CH3COO]- 342.05877 201.5
[M+Na-2H]- 304.01959 163.0
[M]+ 283.04437 164.7
[M]- 283.04547 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.