4-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzonitrile Formula: C16H10N4O3S MolecularWeight: 338.3406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN=C(O2)SCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NN=C(O2)SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H10N4O3S/c17-9-11-4-6-12(7-5-11)10-24-16-19-18-15(23-16)13-2-1-3-14(8-13)20(21)22/h1-8H,10H2