3-(3-methoxyphenyl)-5-[1-(phenylsulfonyl)piperidin-3-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-methoxyphenyl)-5-[1-(phenylsulfonyl)piperidin-3-yl]-1,2,4-oxadiazole Openeye Name: 5-[1-(benzenesulfonyl)-3-piperidyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[1-(benzenesulfonyl)-3-piperidinyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[1-(benzenesulfonyl)piperidin-3-yl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-(1-besyl-3-piperidyl)-3-(3-methoxyphenyl)-1,2,4-oxadiazole Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NOC(=N2)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NOC(=N2)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O4S/c1-26-17-9-5-7-15(13-17)19-21-20(27-22-19)16-8-6-12-23(14-16)28(24,25)18-10-3-2-4-11-18/h2-5,7,9-11,13,16H,6,8,12,14H2,1H3