3-[3-(4-methoxyphenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[3-(4-methoxyphenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Openeye Name: 3-[3-(4-methoxyphenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole CAS Name: 3-[3-(4-methoxyphenoxy)propylthio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[3-(4-methoxyphenoxy)propylsulfanyl]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Traditional Name: 3-[3-(4-methoxyphenoxy)propylthio]-5-(4-methoxyphenyl)-1H-1,2,4-triazole Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2)SCCCOC3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)SCCCOC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H21N3O3S/c1-23-15-6-4-14(5-7-15)18-20-19(22-21-18)26-13-3-12-25-17-10-8-16(24-2)9-11-17/h4-11H,3,12-13H2,1-2H3,(H,20,21,22)