N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-4-nitro-benzamide

Systemtic Name: N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-4-nitro-benzamide CAS Name: N-[5-[4-(methylthio)phenyl]-1,3,4-oxadiazol-2-yl]-4-nitrobenzamide IUPAC Name: N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[5-[4-(methylthio)phenyl]-1,3,4-oxadiazol-2-yl]-4-nitro-benzamide Formula: C16H12N4O4S MolecularWeight: 356.35588

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4S/c1-25-13-8-4-11(5-9-13)15-18-19-16(24-15)17-14(21)10-2-6-12(7-3-10)20(22)23/h2-9H,1H3,(H,17,19,21)