N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-4-(methylsulfamoyl)benzamide

Systemtic Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-4-(methylsulfamoyl)benzamide Openeye Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-4-(methylsulfamoyl)benzamide CAS Name: N-[(2S)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-4-(methylsulfamoyl)benzamide IUPAC Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]-4-(methylsulfamoyl)benzamide Traditional Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-4-(methylsulfamoyl)benzamide Formula: C20H28N3O3S2+ MolecularWeight: 422.58462

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC=C(C=C2)S(=O)(=O)NC)C3=CC=CS3

InChI

InChI=1S/C20H27N3O3S2/c1-15-9-11-23(12-10-15)18(19-4-3-13-27-19)14-22-20(24)16-5-7-17(8-6-16)28(25,26)21-2/h3-8,13,15,18,21H,9-12,14H2,1-2H3,(H,22,24)/p+1/t18-/m0/s1