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

Systemtic Name: 2-[(2,5-dimethylphenoxy)methyl]-5-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-[(2,5-dimethylphenoxy)methyl]-5-[(2-methoxy-5-nitro-phenyl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-[(2,5-dimethylphenoxy)methyl]-5-[(2-methoxy-5-nitrophenyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-[(2,5-dimethylphenoxy)methyl]-5-[(2-methoxy-5-nitrophenyl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-[(2,5-dimethylphenoxy)methyl]-5-[(2-methoxy-5-nitro-benzyl)thio]-1,3,4-oxadiazole Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC2=NN=C(O2)SCC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC2=NN=C(O2)SCC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19N3O5S/c1-12-4-5-13(2)17(8-12)26-10-18-20-21-19(27-18)28-11-14-9-15(22(23)24)6-7-16(14)25-3/h4-9H,10-11H2,1-3H3