3-(tert-butylsulfamoyl)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-5-[(6-methylpyridin-2-yl)methylamino]benzamide

Systemtic Name: 3-(tert-butylsulfamoyl)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-5-[(6-methylpyridin-2-yl)methylamino]benzamide Openeye Name: 3-(tert-butylsulfamoyl)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-5-[(6-methyl-2-pyridyl)methylamino]benzamide CAS Name: 3-(tert-butylsulfamoyl)-N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-5-[(6-methyl-2-pyridinyl)methylamino]benzamide IUPAC Name: 3-(tert-butylsulfamoyl)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-5-[(6-methylpyridin-2-yl)methylamino]benzamide Traditional Name: 3-(tert-butylsulfamoyl)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-5-[(6-methyl-2-pyridyl)methylamino]benzamide Formula: C25H38N5O3S+ MolecularWeight: 488.66592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CNC2=CC(=CC(=C2)C(=O)NCC3CCC[NH+](C3)C)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CC1=NC(=CC=C1)CNC2=CC(=CC(=C2)C(=O)NC[C@H]3CCC[NH+](C3)C)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C25H37N5O3S/c1-18-8-6-10-21(28-18)16-26-22-12-20(13-23(14-22)34(32,33)29-25(2,3)4)24(31)27-15-19-9-7-11-30(5)17-19/h6,8,10,12-14,19,26,29H,7,9,11,15-17H2,1-5H3,(H,27,31)/p+1/t19-/m1/s1