1-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol

Systemtic Name: 1-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol Openeye Name: 1-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol CAS Name: 1-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-3-(4-phenylphenoxy)-2-propanol IUPAC Name: 1-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol Traditional Name: 1-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-3-(4-phenylphenoxy)propan-2-ol Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(COC2=CC=C(C=C2)C3=CC=CC=C3)O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C(=NN=C1SCC(COC2=CC=C(C=C2)C3=CC=CC=C3)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H27N3O3S/c1-3-29-25(21-11-13-23(31-2)14-12-21)27-28-26(29)33-18-22(30)17-32-24-15-9-20(10-16-24)19-7-5-4-6-8-19/h4-16,22,30H,3,17-18H2,1-2H3