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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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