3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole Openeye Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole CAS Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylthio]-5-(4-ethylphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole Traditional Name: 3-[(4,5-dimethoxy-2-methyl-benzyl)thio]-5-(4-ethylphenyl)-1H-1,2,4-triazole Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC(=C(C=C3C)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC(=C(C=C3C)OC)OC

InChI

InChI=1S/C20H23N3O2S/c1-5-14-6-8-15(9-7-14)19-21-20(23-22-19)26-12-16-11-18(25-4)17(24-3)10-13(16)2/h6-11H,5,12H2,1-4H3,(H,21,22,23)