2-(3-methylbutylsulfanyl)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole

Systemtic Name: 2-(3-methylbutylsulfanyl)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Openeye Name: 2-isopentylsulfanyl-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole CAS Name: 2-(3-methylbutylthio)-5-(4-piperidin-1-iumyl)-1,3,4-oxadiazole IUPAC Name: 2-(3-methylbutylsulfanyl)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Traditional Name: 2-(isoamylthio)-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Formula: C12H22N3OS+ MolecularWeight: 256.38758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NN=C(O1)C2CC[NH2+]CC2

Isomeric SMILES

CC(C)CCSC1=NN=C(O1)C2CC[NH2+]CC2

InChI

InChI=1S/C12H21N3OS/c1-9(2)5-8-17-12-15-14-11(16-12)10-3-6-13-7-4-10/h9-10,13H,3-8H2,1-2H3/p+1