5-(4-methylphenyl)-3-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 5-(4-methylphenyl)-3-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanylmethyl]-5-(p-tolyl)-1,2,4-oxadiazole CAS Name: 5-(4-methylphenyl)-3-[[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-methylphenyl)-3-[(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-[[(5-piperidinosulfonyl-2-pyridyl)thio]methyl]-5-(p-tolyl)-1,2,4-oxadiazole Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H22N4O3S2/c1-15-5-7-16(8-6-15)20-22-18(23-27-20)14-28-19-10-9-17(13-21-19)29(25,26)24-11-3-2-4-12-24/h5-10,13H,2-4,11-12,14H2,1H3