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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(O2)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CSC2=NN=C(O2)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C18H17N3O5S/c1-11-12(5-4-6-16(11)21(22)23)10-27-18-20-19-17(26-18)13-7-14(24-2)9-15(8-13)25-3/h4-9H,10H2,1-3H3