1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoate

Systemtic Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanylethanoate Openeye Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetate CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]acetic acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester IUPAC Name: 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl 2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetate Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]acetic acid 1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl ester Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=CC=C2)OC(=O)CSC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC(C1=NN=C(O1)C2=CC=CC=C2)OC(=O)CSC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H15N3O4S/c1-12(16-18-19-17(24-16)13-7-3-2-4-8-13)23-15(21)11-25-14-9-5-6-10-20(14)22/h2-10,12H,11H2,1H3