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

Systemtic Name: 3-[(2,4-dimethylphenoxy)methyl]-4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Openeye Name: 3-[(2,4-dimethylphenoxy)methyl]-4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(2,4-dimethylphenoxy)methyl]-4-ethyl-5-(2-phenoxyethylthio)-1,2,4-triazole IUPAC Name: 3-[(2,4-dimethylphenoxy)methyl]-4-ethyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 3-[(2,4-dimethylphenoxy)methyl]-4-ethyl-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCOC2=CC=CC=C2)COC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCN1C(=NN=C1SCCOC2=CC=CC=C2)COC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H25N3O2S/c1-4-24-20(15-26-19-11-10-16(2)14-17(19)3)22-23-21(24)27-13-12-25-18-8-6-5-7-9-18/h5-11,14H,4,12-13,15H2,1-3H3