4-ethyl-3-(4-methoxyphenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(4-methoxyphenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-ethyl-3-(4-methoxyphenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-ethyl-3-(4-methoxyphenyl)-5-[(2-phenoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-ethyl-3-(4-methoxyphenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-ethyl-3-(4-methoxyphenyl)-5-[(2-phenoxybenzyl)thio]-1,2,4-triazole Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2OC3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2OC3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H23N3O2S/c1-3-27-23(18-13-15-20(28-2)16-14-18)25-26-24(27)30-17-19-9-7-8-12-22(19)29-21-10-5-4-6-11-21/h4-16H,3,17H2,1-2H3