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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4S/c1-11-6-8-12(9-7-11)15(21)10-25-17-19-18-16(24-17)13-4-2-3-5-14(13)20(22)23/h2-9H,10H2,1H3