N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-5-[(4-methylphenyl)methylsulfonylmethyl]furan-2-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-5-[(4-methylphenyl)methylsulfonylmethyl]furan-2-carboxamide Openeye Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-5-(p-tolylmethylsulfonylmethyl)furan-2-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-piperidin-1-iumyl)propyl]-5-[(4-methylphenyl)methylsulfonylmethyl]-2-furancarboxamide IUPAC Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-5-[(4-methylphenyl)methylsulfonylmethyl]furan-2-carboxamide Traditional Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-5-[(4-methylbenzyl)sulfonylmethyl]-2-furamide Formula: C24H35N2O4S+ MolecularWeight: 447.6107

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCNC(=O)C2=CC=C(O2)CS(=O)(=O)CC3=CC=C(C=C3)C)C

Isomeric SMILES

CC1CC(C[NH+](C1)CCCNC(=O)C2=CC=C(O2)CS(=O)(=O)CC3=CC=C(C=C3)C)C

InChI

InChI=1S/C24H34N2O4S/c1-18-5-7-21(8-6-18)16-31(28,29)17-22-9-10-23(30-22)24(27)25-11-4-12-26-14-19(2)13-20(3)15-26/h5-10,19-20H,4,11-17H2,1-3H3,(H,25,27)/p+1