5-(2-methylphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(2-methylphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-(o-tolyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(2-methylphenyl)-3-[(4-methyl-1-piperidin-1-iumyl)methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(2-methylphenyl)-3-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 3-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-(o-tolyl)-1,3,4-oxadiazole-2-thione Formula: C16H22N3OS+ MolecularWeight: 304.43038

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CN2C(=S)OC(=N2)C3=CC=CC=C3C

Isomeric SMILES

CC1CC[NH+](CC1)CN2C(=S)OC(=N2)C3=CC=CC=C3C

InChI

InChI=1S/C16H21N3OS/c1-12-7-9-18(10-8-12)11-19-16(21)20-15(17-19)14-6-4-3-5-13(14)2/h3-6,12H,7-11H2,1-2H3/p+1