2-(4-nitrophenyl)-5-[(1R)-1-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethyl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-nitrophenyl)-5-[(1R)-1-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethyl]-1,3,4-oxadiazole Openeye Name: 2-(4-nitrophenyl)-5-[(1R)-1-(1-oxidopyridin-1-ium-2-yl)sulfanylethyl]-1,3,4-oxadiazole CAS Name: 2-(4-nitrophenyl)-5-[(1R)-1-[(1-oxido-2-pyridin-1-iumyl)thio]ethyl]-1,3,4-oxadiazole IUPAC Name: 2-(4-nitrophenyl)-5-[(1R)-1-(1-oxidopyridin-1-ium-2-yl)sulfanylethyl]-1,3,4-oxadiazole Traditional Name: 2-(4-nitrophenyl)-5-[(1R)-1-[(1-oxidopyridin-1-ium-2-yl)thio]ethyl]-1,3,4-oxadiazole Formula: C15H12N4O4S MolecularWeight: 344.34518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=[N+]3[O-]

Isomeric SMILES

C[C@H](C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])SC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C15H12N4O4S/c1-10(24-13-4-2-3-9-18(13)20)14-16-17-15(23-14)11-5-7-12(8-6-11)19(21)22/h2-10H,1H3/t10-/m1/s1