3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Openeye Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 3-[2-(3,5-dimethylphenoxy)ethylthio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Traditional Name: 3-[2-(3,5-dimethylphenoxy)ethylthio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSC2=NNC(=N2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCSC2=NNC(=N2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C19H21N3O2S/c1-13-10-14(2)12-17(11-13)24-8-9-25-19-20-18(21-22-19)15-4-6-16(23-3)7-5-15/h4-7,10-12H,8-9H2,1-3H3,(H,20,21,22)