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

Systemtic Name: 3-[(4-methoxyphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-[(4-methoxyphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(4-methoxyphenoxy)methyl]-5-(2-phenoxyethylthio)-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-[(4-methoxyphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole Traditional Name: 4-benzyl-3-[(4-methoxyphenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CC=C3)SCCOC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)OCC2=NN=C(N2CC3=CC=CC=C3)SCCOC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O3S/c1-29-21-12-14-23(15-13-21)31-19-24-26-27-25(28(24)18-20-8-4-2-5-9-20)32-17-16-30-22-10-6-3-7-11-22/h2-15H,16-19H2,1H3