CID 40711

53297-79-3

Structural Information

Molecular Formula
C15H14ClN3O3S
SMILES
C1C(=O)N(CN1C2=CC=CC=C2)C3=C(C=C(C=C3)S(=O)(=O)N)Cl
InChI
InChI=1S/C15H14ClN3O3S/c16-13-8-12(23(17,21)22)6-7-14(13)19-10-18(9-15(19)20)11-4-2-1-3-5-11/h1-8H,9-10H2,(H2,17,21,22)
InChIKey
RDRUUAYFDUPERA-UHFFFAOYSA-N
Compound name
3-chloro-4-(5-oxo-3-phenylimidazolidin-1-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

351.04443 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.05171 179.6
[M+Na]+ 374.03365 189.5
[M-H]- 350.03715 187.2
[M+NH4]+ 369.07825 192.6
[M+K]+ 390.00759 182.9
[M+H-H2O]+ 334.04169 171.9
[M+HCOO]- 396.04263 190.6
[M+CH3COO]- 410.05828 207.6
[M+Na-2H]- 372.01910 179.5
[M]+ 351.04388 181.4
[M]- 351.04498 181.4
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