3-(3,4-dimethoxyphenyl)-5-[(4-methylphenyl)sulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[(4-methylphenyl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-(3,4-dimethoxyphenyl)-5-(p-tolylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[[(4-methylphenyl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[(4-methylphenyl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-(3,4-dimethoxyphenyl)-5-[(p-tolylthio)methyl]-1,2,4-oxadiazole Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3S/c1-12-4-7-14(8-5-12)24-11-17-19-18(20-23-17)13-6-9-15(21-2)16(10-13)22-3/h4-10H,11H2,1-3H3