2-[(4-methylphenyl)methylsulfanyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Openeye Name: 2-piperidin-1-ium-4-yl-5-(p-tolylmethylsulfanyl)-1,3,4-oxadiazole CAS Name: 2-[(4-methylphenyl)methylthio]-5-(4-piperidin-1-iumyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Traditional Name: 2-[(4-methylbenzyl)thio]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(O2)C3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(O2)C3CC[NH2+]CC3

InChI

InChI=1S/C15H19N3OS/c1-11-2-4-12(5-3-11)10-20-15-18-17-14(19-15)13-6-8-16-9-7-13/h2-5,13,16H,6-10H2,1H3/p+1