2-naphthalen-2-yl-5-[(E)-3-(4-nitrophenyl)sulfonylprop-2-enyl]sulfanyl-1,3,4-oxadiazole

Systemtic Name: 2-naphthalen-2-yl-5-[(E)-3-(4-nitrophenyl)sulfonylprop-2-enyl]sulfanyl-1,3,4-oxadiazole Openeye Name: 2-(2-naphthyl)-5-[(E)-3-(4-nitrophenyl)sulfonylallyl]sulfanyl-1,3,4-oxadiazole CAS Name: 2-(2-naphthalenyl)-5-[[(E)-3-(4-nitrophenyl)sulfonylprop-2-enyl]thio]-1,3,4-oxadiazole IUPAC Name: 2-naphthalen-2-yl-5-[(E)-3-(4-nitrophenyl)sulfonylprop-2-enyl]sulfanyl-1,3,4-oxadiazole Traditional Name: 2-(2-naphthyl)-5-[[(E)-3-nosylallyl]thio]-1,3,4-oxadiazole Formula: C21H15N3O5S2 MolecularWeight: 453.4909

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NN=C(O3)SCC=CS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NN=C(O3)SC/C=C/S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O5S2/c25-24(26)18-8-10-19(11-9-18)31(27,28)13-3-12-30-21-23-22-20(29-21)17-7-6-15-4-1-2-5-16(15)14-17/h1-11,13-14H,12H2/b13-3+