1-[4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitro-phenyl]ethanone Openeye Name: 1-[3-nitro-4-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]phenyl]ethanone CAS Name: 1-[4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3-nitrophenyl]ethanone Traditional Name: 1-[3-nitro-4-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]thio]phenyl]ethanone Formula: C17H13N3O4S MolecularWeight: 355.36782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(O2)SC3=C(C=C(C=C3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(O2)SC3=C(C=C(C=C3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4S/c1-10-3-5-12(6-4-10)16-18-19-17(24-16)25-15-8-7-13(11(2)21)9-14(15)20(22)23/h3-9H,1-2H3