N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-2-[(4-fluorophenyl)thio]acetamide Formula: C20H23ClFN2OS+ MolecularWeight: 393.925823

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CSC2=CC=C(C=C2)F)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CSC2=CC=C(C=C2)F)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H22ClFN2OS/c21-16-3-1-15(2-4-16)13-24-11-9-18(10-12-24)23-20(25)14-26-19-7-5-17(22)6-8-19/h1-8,18H,9-14H2,(H,23,25)/p+1