CID 59837562

3-cyclohexyl-n-(dimethylsulfamoyl)-1h-indole-6-carboxamide

Structural Information

Molecular Formula
C17H23N3O3S
SMILES
CN(C)S(=O)(=O)NC(=O)C1=CC2=C(C=C1)C(=CN2)C3CCCCC3
InChI
InChI=1S/C17H23N3O3S/c1-20(2)24(22,23)19-17(21)13-8-9-14-15(11-18-16(14)10-13)12-6-4-3-5-7-12/h8-12,18H,3-7H2,1-2H3,(H,19,21)
InChIKey
VUFCMDJQWJPAAG-UHFFFAOYSA-N
Compound name
3-cyclohexyl-N-(dimethylsulfamoyl)-1H-indole-6-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

349.14603 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.15331 179.3
[M+Na]+ 372.13525 184.3
[M-H]- 348.13875 185.1
[M+NH4]+ 367.17985 193.4
[M+K]+ 388.10919 180.4
[M+H-H2O]+ 332.14329 172.0
[M+HCOO]- 394.14423 193.6
[M+CH3COO]- 408.15988 213.3
[M+Na-2H]- 370.12070 181.1
[M]+ 349.14548 179.0
[M]- 349.14658 179.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe