3-[(2,5-dimethylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-[(2,5-dimethylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Openeye Name: 3-[(2,5-dimethylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(2,5-dimethylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazole IUPAC Name: 3-[(2,5-dimethylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 3-[(2,5-dimethylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC2=NN=C(N2C)SCCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC2=NN=C(N2C)SCCOC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O2S/c1-15-9-10-16(2)18(13-15)25-14-19-21-22-20(23(19)3)26-12-11-24-17-7-5-4-6-8-17/h4-10,13H,11-12,14H2,1-3H3