3-(tert-butylsulfamoyl)-5-(furan-3-ylmethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 3-(tert-butylsulfamoyl)-5-(furan-3-ylmethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide Openeye Name: 3-(tert-butylsulfamoyl)-5-(3-furylmethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide CAS Name: 3-(tert-butylsulfamoyl)-5-(3-furanylmethylamino)-N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 3-(tert-butylsulfamoyl)-5-(furan-3-ylmethylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide Traditional Name: 3-(tert-butylsulfamoyl)-5-(3-furfurylamino)-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]benzamide Formula: C23H35N4O4S+ MolecularWeight: 463.6134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=CC(=C1)NCC2=COC=C2)C(=O)NCC3CCC[NH+](C3)C

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=CC(=C1)NCC2=COC=C2)C(=O)NC[C@H]3CCC[NH+](C3)C

InChI

InChI=1S/C23H34N4O4S/c1-23(2,3)26-32(29,30)21-11-19(10-20(12-21)24-14-18-7-9-31-16-18)22(28)25-13-17-6-5-8-27(4)15-17/h7,9-12,16-17,24,26H,5-6,8,13-15H2,1-4H3,(H,25,28)/p+1/t17-/m1/s1