4-ethyl-3-[2-(3-methoxyphenoxy)ethylsulfanyl]-5-(3-propan-2-yloxyphenyl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[2-(3-methoxyphenoxy)ethylsulfanyl]-5-(3-propan-2-yloxyphenyl)-1,2,4-triazole Openeye Name: 4-ethyl-3-(3-isopropoxyphenyl)-5-[2-(3-methoxyphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 4-ethyl-3-[2-(3-methoxyphenoxy)ethylthio]-5-(3-propan-2-yloxyphenyl)-1,2,4-triazole IUPAC Name: 4-ethyl-3-[2-(3-methoxyphenoxy)ethylsulfanyl]-5-(3-propan-2-yloxyphenyl)-1,2,4-triazole Traditional Name: 4-ethyl-3-(3-isopropoxyphenyl)-5-[2-(3-methoxyphenoxy)ethylthio]-1,2,4-triazole Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S/c1-5-25-21(17-8-6-11-20(14-17)28-16(2)3)23-24-22(25)29-13-12-27-19-10-7-9-18(15-19)26-4/h6-11,14-16H,5,12-13H2,1-4H3