3-pyridin-2-yl-5-[(4-thiomorpholin-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-pyridin-2-yl-5-[(4-thiomorpholin-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(2-pyridyl)-5-[(4-thiomorpholinopiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-(2-pyridinyl)-5-[(4-thiomorpholin-4-yl-1-piperidin-1-iumyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-pyridin-2-yl-5-[(4-thiomorpholin-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(2-pyridyl)-5-[(4-thiomorpholinopiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Formula: C17H24N5OS+ MolecularWeight: 346.47036

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CCSCC2)CC3=NC(=NO3)C4=CC=CC=N4

Isomeric SMILES

C1C[NH+](CCC1N2CCSCC2)CC3=NC(=NO3)C4=CC=CC=N4

InChI

InChI=1S/C17H23N5OS/c1-2-6-18-15(3-1)17-19-16(23-20-17)13-21-7-4-14(5-8-21)22-9-11-24-12-10-22/h1-3,6,14H,4-5,7-13H2/p+1