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

Systemtic Name: 2-(furan-2-yl)-5-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1,3,4-oxadiazole Openeye Name: 2-(2-furyl)-5-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1,3,4-oxadiazole CAS Name: 2-(2-furanyl)-5-[(4-methylsulfonyl-2-nitrophenyl)thio]-1,3,4-oxadiazole IUPAC Name: 2-(furan-2-yl)-5-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-1,3,4-oxadiazole Traditional Name: 2-(2-furyl)-5-[(4-mesyl-2-nitro-phenyl)thio]-1,3,4-oxadiazole Formula: C13H9N3O6S2 MolecularWeight: 367.35706

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=C(O2)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=C(O2)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O6S2/c1-24(19,20)8-4-5-11(9(7-8)16(17)18)23-13-15-14-12(22-13)10-3-2-6-21-10/h2-7H,1H3