2-[(4-nitrophenyl)methylsulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-nitrophenyl)methylsulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole CAS Name: 2-[(4-nitrophenyl)methylthio]-5-(phenoxymethyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-nitrophenyl)methylsulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole Traditional Name: 2-[(4-nitrobenzyl)thio]-5-(phenoxymethyl)-1,3,4-oxadiazole Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S/c20-19(21)13-8-6-12(7-9-13)11-24-16-18-17-15(23-16)10-22-14-4-2-1-3-5-14/h1-9H,10-11H2