2-(furan-2-yl)-5-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-1,3,4-oxadiazole

Systemtic Name: 2-(furan-2-yl)-5-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-1,3,4-oxadiazole Openeye Name: 2-(2-furyl)-5-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)sulfanyl-1,3,4-oxadiazole CAS Name: 2-(2-furanyl)-5-[[4-nitro-2-(1-pyrrolidinylsulfonyl)phenyl]thio]-1,3,4-oxadiazole IUPAC Name: 2-(furan-2-yl)-5-(4-nitro-2-pyrrolidin-1-ylsulfonylphenyl)sulfanyl-1,3,4-oxadiazole Traditional Name: 2-(2-furyl)-5-[(4-nitro-2-pyrrolidinosulfonyl-phenyl)thio]-1,3,4-oxadiazole Formula: C16H14N4O6S2 MolecularWeight: 422.43556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NN=C(O3)C4=CC=CO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=NN=C(O3)C4=CC=CO4

InChI

InChI=1S/C16H14N4O6S2/c21-20(22)11-5-6-13(14(10-11)28(23,24)19-7-1-2-8-19)27-16-18-17-15(26-16)12-4-3-9-25-12/h3-6,9-10H,1-2,7-8H2