S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-(4-nitrophenyl)ethanethioate

Systemtic Name: S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-(4-nitrophenyl)ethanethioate Openeye Name: S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-(4-nitrophenyl)ethanethioate CAS Name: 2-(4-nitrophenyl)ethanethioic acid S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] ester IUPAC Name: S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] 2-(4-nitrophenyl)ethanethioate Traditional Name: 2-(4-nitrophenyl)ethanethioic acid S-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl] ester Formula: C17H13N3O5S MolecularWeight: 371.36722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(O2)SC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(O2)SC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5S/c1-24-14-4-2-3-12(10-14)16-18-19-17(25-16)26-15(21)9-11-5-7-13(8-6-11)20(22)23/h2-8,10H,9H2,1H3