5-(3-chloranyl-1-benzothiophen-2-yl)-3-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(3-chloranyl-1-benzothiophen-2-yl)-3-[[(3R)-3-oxidanylpiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Openeye Name: 5-(3-chlorobenzothiophen-2-yl)-3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione CAS Name: 5-(3-chloro-1-benzothiophen-2-yl)-3-[[(3R)-3-hydroxy-1-piperidin-1-iumyl]methyl]-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(3-chloro-1-benzothiophen-2-yl)-3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Traditional Name: 5-(3-chlorobenzothiophen-2-yl)-3-[[(3R)-3-hydroxypiperidin-1-ium-1-yl]methyl]-1,3,4-oxadiazole-2-thione Formula: C16H17ClN3O2S2+ MolecularWeight: 382.90808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CN2C(=S)OC(=N2)C3=C(C4=CC=CC=C4S3)Cl)O

Isomeric SMILES

C1C[C@H](C[NH+](C1)CN2C(=S)OC(=N2)C3=C(C4=CC=CC=C4S3)Cl)O

InChI

InChI=1S/C16H16ClN3O2S2/c17-13-11-5-1-2-6-12(11)24-14(13)15-18-20(16(23)22-15)9-19-7-3-4-10(21)8-19/h1-2,5-6,10,21H,3-4,7-9H2/p+1/t10-/m1/s1