5-[(2,4-dimethylphenyl)sulfanylmethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(2,4-dimethylphenyl)sulfanylmethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(2,4-dimethylphenyl)sulfanylmethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[[(2,4-dimethylphenyl)thio]methyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2,4-dimethylphenyl)sulfanylmethyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(2,4-dimethylphenyl)thio]methyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=NC(=NO2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=NC(=NO2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C18H18N2O2S/c1-12-4-9-16(13(2)10-12)23-11-17-19-18(20-22-17)14-5-7-15(21-3)8-6-14/h4-10H,11H2,1-3H3