1-[[5-(4-fluorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[[5-(4-fluorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[[5-(4-fluorophenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[[5-(4-fluorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[5-(4-fluorophenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[[5-(4-fluorophenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C21H22FN4O2S+ MolecularWeight: 413.488383

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CN3C(=S)OC(=N3)C4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CN3C(=S)OC(=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O2S/c22-17-8-6-16(7-9-17)20-24-26(21(29)28-20)14-25-12-10-15(11-13-25)19(27)23-18-4-2-1-3-5-18/h1-9,15H,10-14H2,(H,23,27)/p+1