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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methylsulfonylphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methylsulfonylphenyl)sulfonyl-4-piperidyl]-1,2,4-oxadiazole CAS Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methylsulfonylphenyl)sulfonyl-4-piperidinyl]-1,2,4-oxadiazole IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-methylsulfonylphenyl)sulfonylpiperidin-4-yl]-1,2,4-oxadiazole Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-[1-(3-mesylphenyl)sulfonyl-4-piperidyl]-1,2,4-oxadiazole Formula: C21H21N3O7S2 MolecularWeight: 491.53734

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H21N3O7S2/c1-32(25,26)16-3-2-4-17(12-16)33(27,28)24-9-7-14(8-10-24)21-22-20(23-31-21)15-5-6-18-19(11-15)30-13-29-18/h2-6,11-12,14H,7-10,13H2,1H3