2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-5-(furan-2-yl)-1,3,4-oxadiazole

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-5-(furan-2-yl)-1,3,4-oxadiazole Openeye Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanylmethyl]-5-(2-furyl)-1,3,4-oxadiazole CAS Name: 2-[[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]methyl]-5-(2-furanyl)-1,3,4-oxadiazole IUPAC Name: 2-[[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylmethyl]-5-(furan-2-yl)-1,3,4-oxadiazole Traditional Name: 2-[[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]methyl]-5-(2-furyl)-1,3,4-oxadiazole Formula: C18H20N4O4S2 MolecularWeight: 420.5058

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NN=C(O3)C4=CC=CO4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=NN=C(O3)C4=CC=CO4

InChI

InChI=1S/C18H20N4O4S2/c23-28(24,22-9-3-1-2-4-10-22)14-7-8-17(19-12-14)27-13-16-20-21-18(26-16)15-6-5-11-25-15/h5-8,11-12H,1-4,9-10,13H2