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

Systemtic Name: 3-[1-(2,5-dimethylphenyl)sulfonylpiperidin-4-yl]-5-(4-methylphenyl)-1,2,4-oxadiazole Openeye Name: 3-[1-(2,5-dimethylphenyl)sulfonyl-4-piperidyl]-5-(p-tolyl)-1,2,4-oxadiazole CAS Name: 3-[1-(2,5-dimethylphenyl)sulfonyl-4-piperidinyl]-5-(4-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 3-[1-(2,5-dimethylphenyl)sulfonylpiperidin-4-yl]-5-(4-methylphenyl)-1,2,4-oxadiazole Traditional Name: 3-[1-(2,5-dimethylphenyl)sulfonyl-4-piperidyl]-5-(p-tolyl)-1,2,4-oxadiazole Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)C3CCN(CC3)S(=O)(=O)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C22H25N3O3S/c1-15-5-8-19(9-6-15)22-23-21(24-28-22)18-10-12-25(13-11-18)29(26,27)20-14-16(2)4-7-17(20)3/h4-9,14,18H,10-13H2,1-3H3