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

Systemtic Name: 3-(3-methylphenyl)-5-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Openeye Name: 3-(m-tolyl)-5-[1-(p-tolylsulfonyl)-4-piperidyl]-1,2,4-oxadiazole CAS Name: 3-(3-methylphenyl)-5-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-methylphenyl)-5-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Traditional Name: 3-(m-tolyl)-5-(1-tosyl-4-piperidyl)-1,2,4-oxadiazole Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC(=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC(=CC=C4)C

InChI

InChI=1S/C21H23N3O3S/c1-15-6-8-19(9-7-15)28(25,26)24-12-10-17(11-13-24)21-22-20(23-27-21)18-5-3-4-16(2)14-18/h3-9,14,17H,10-13H2,1-2H3