CID 3384763

Refchem:521873

Structural Information

Molecular Formula
C19H15ClN2O2S
SMILES
C1=CC=C(C=C1)C(=NS(=O)(=O)C2=CC=C(C=C2)Cl)NC3=CC=CC=C3
InChI
InChI=1S/C19H15ClN2O2S/c20-16-11-13-18(14-12-16)25(23,24)22-19(15-7-3-1-4-8-15)21-17-9-5-2-6-10-17/h1-14H,(H,21,22)
InChIKey
UOGGNLMTJDRDFW-UHFFFAOYSA-N
Compound name
N'-(4-chlorophenyl)sulfonyl-N-phenylbenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.0543 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.061576 184.4
[M+Na]+ 393.043518 191.7
[M-H]- 369.047024 195.2
[M+NH4]+ 388.088123 197.3
[M+K]+ 409.017458 184.6
[M+H-H2O]+ 353.051560 175.9
[M+HCOO]- 415.052501 200.7
[M+CH3COO]- 429.068151 215.4
[M+Na-2H]- 391.028966 189.7
[M]+ 370.05375142 187.4
[M]- 370.05484858 187.4
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

No patent data available for this compound.