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

Systemtic Name: N-phenyl-1-[(2-sulfanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-phenyl-1-[[5-(2-thienyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: N-phenyl-1-[(2-sulfanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-phenyl-1-[(2-sulfanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-phenyl-1-[[5-(2-thienyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C19H21N4O2S2+ MolecularWeight: 401.52564

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CN3C(=S)OC(=N3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CN3C(=S)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H20N4O2S2/c24-17(20-15-5-2-1-3-6-15)14-8-10-22(11-9-14)13-23-19(26)25-18(21-23)16-7-4-12-27-16/h1-7,12,14H,8-11,13H2,(H,20,24)/p+1