3-(3-chlorophenyl)-5-[1-(4-methylphenyl)sulfonylpiperidin-3-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-chlorophenyl)-5-[1-(4-methylphenyl)sulfonylpiperidin-3-yl]-1,2,4-oxadiazole Openeye Name: 3-(3-chlorophenyl)-5-[1-(p-tolylsulfonyl)-3-piperidyl]-1,2,4-oxadiazole CAS Name: 3-(3-chlorophenyl)-5-[1-(4-methylphenyl)sulfonyl-3-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-chlorophenyl)-5-[1-(4-methylphenyl)sulfonylpiperidin-3-yl]-1,2,4-oxadiazole Traditional Name: 3-(3-chlorophenyl)-5-(1-tosyl-3-piperidyl)-1,2,4-oxadiazole Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NC(=NO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NC(=NO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-14-7-9-18(10-8-14)28(25,26)24-11-3-5-16(13-24)20-22-19(23-27-20)15-4-2-6-17(21)12-15/h2,4,6-10,12,16H,3,5,11,13H2,1H3