3-[(3,4-dimethylphenoxy)methyl]-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-[(3,4-dimethylphenoxy)methyl]-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-[(3,4-dimethylphenoxy)methyl]-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(3,4-dimethylphenoxy)methyl]-4-ethyl-5-[(3-methoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-[(3,4-dimethylphenoxy)methyl]-4-ethyl-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-[(3,4-dimethylphenoxy)methyl]-4-ethyl-5-(m-anisylthio)-1,2,4-triazole Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=CC=C2)OC)COC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=CC=C2)OC)COC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C21H25N3O2S/c1-5-24-20(13-26-19-10-9-15(2)16(3)11-19)22-23-21(24)27-14-17-7-6-8-18(12-17)25-4/h6-12H,5,13-14H2,1-4H3