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

Systemtic Name: N-[5-(3-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[5-(3-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-4-nitro-benzamide CAS Name: N-[5-[3-(methylthio)phenyl]-1,3,4-oxadiazol-2-yl]-4-nitrobenzamide IUPAC Name: N-[5-(3-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[5-[3-(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=CC(=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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