3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole Openeye Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole CAS Name: 3-[2-(4-methoxyphenoxy)ethylthio]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole IUPAC Name: 3-[2-(4-methoxyphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole Traditional Name: 3-[2-(4-methoxyphenoxy)ethylthio]-5-(4-methoxyphenyl)-4-phenethyl-1,2,4-triazole Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SCCOC4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SCCOC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H27N3O3S/c1-30-22-10-8-21(9-11-22)25-27-28-26(29(25)17-16-20-6-4-3-5-7-20)33-19-18-32-24-14-12-23(31-2)13-15-24/h3-15H,16-19H2,1-2H3