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

Systemtic Name: 3-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Openeye Name: 3-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazole IUPAC Name: 3-[(2-ethoxy-4-methylphenoxy)methyl]-4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 3-[(2-ethoxy-4-methyl-phenoxy)methyl]-4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2C)SCCOC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2C)SCCOC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O3S/c1-4-25-19-14-16(2)10-11-18(19)27-15-20-22-23-21(24(20)3)28-13-12-26-17-8-6-5-7-9-17/h5-11,14H,4,12-13,15H2,1-3H3