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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN=C(O2)CSC3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN=C(O2)CSC3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

InChI

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