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

Systemtic Name: 3-(3-chlorophenyl)-5-[(4-thiomorpholin-4-ium-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(3-chlorophenyl)-5-[(4-thiomorpholin-4-ium-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-(3-chlorophenyl)-5-[[4-(4-thiomorpholin-4-iumyl)-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-chlorophenyl)-5-[(4-thiomorpholin-4-ium-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(3-chlorophenyl)-5-[(4-thiomorpholin-4-ium-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Formula: C18H25ClN4OS+2 MolecularWeight: 380.9353

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CCSCC2)CC3=NC(=NO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CCSCC2)CC3=NC(=NO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H23ClN4OS/c19-15-3-1-2-14(12-15)18-20-17(24-21-18)13-22-6-4-16(5-7-22)23-8-10-25-11-9-23/h1-3,12,16H,4-11,13H2/p+2