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

Systemtic Name: 3-(3-methylphenyl)-5-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1,2,4-oxadiazole Openeye Name: 5-[(3S)-1-(benzenesulfonyl)-3-piperidyl]-3-(m-tolyl)-1,2,4-oxadiazole CAS Name: 5-[(3S)-1-(benzenesulfonyl)-3-piperidinyl]-3-(3-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(3S)-1-(benzenesulfonyl)piperidin-3-yl]-3-(3-methylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[(3S)-1-besyl-3-piperidyl]-3-(m-tolyl)-1,2,4-oxadiazole Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)[C@H]3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O3S/c1-15-7-5-8-16(13-15)19-21-20(26-22-19)17-9-6-12-23(14-17)27(24,25)18-10-3-2-4-11-18/h2-5,7-8,10-11,13,17H,6,9,12,14H2,1H3/t17-/m0/s1