2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole Openeye Name: 2-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole CAS Name: 2-[(2-methoxy-5-nitrophenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole IUPAC Name: 2-[(2-methoxy-5-nitrophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,3,4-oxadiazole Traditional Name: 2-[(2-methoxy-5-nitro-benzyl)thio]-5-p-anisyl-1,3,4-oxadiazole Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(O2)SCC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(O2)SCC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H17N3O5S/c1-24-15-6-3-12(4-7-15)9-17-19-20-18(26-17)27-11-13-10-14(21(22)23)5-8-16(13)25-2/h3-8,10H,9,11H2,1-2H3