2-(azepan-1-ium-1-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[4-(2-thiazolylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]acetamide Formula: C17H23N4O3S2+ MolecularWeight: 395.51952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

C1CCC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C17H22N4O3S2/c22-16(13-21-10-3-1-2-4-11-21)19-14-5-7-15(8-6-14)26(23,24)20-17-18-9-12-25-17/h5-9,12H,1-4,10-11,13H2,(H,18,20)(H,19,22)/p+1