2-phenyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,4-oxadiazole

Systemtic Name: 2-phenyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,4-oxadiazole Openeye Name: 2-phenyl-5-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanylmethyl]-1,3,4-oxadiazole CAS Name: 2-phenyl-5-[[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]methyl]-1,3,4-oxadiazole IUPAC Name: 2-phenyl-5-[(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylmethyl]-1,3,4-oxadiazole Traditional Name: 2-phenyl-5-[[(5-pyrrolidinosulfonyl-2-pyridyl)thio]methyl]-1,3,4-oxadiazole Formula: C18H18N4O3S2 MolecularWeight: 402.49052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C18H18N4O3S2/c23-27(24,22-10-4-5-11-22)15-8-9-17(19-12-15)26-13-16-20-21-18(25-16)14-6-2-1-3-7-14/h1-3,6-9,12H,4-5,10-11,13H2