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

Systemtic Name: 1-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-phenylphenoxy)propan-2-ol Openeye Name: 1-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-phenylphenoxy)propan-2-ol CAS Name: 1-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-3-(4-phenylphenoxy)-2-propanol IUPAC Name: 1-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-phenylphenoxy)propan-2-ol Traditional Name: 1-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]-3-(4-phenylphenoxy)propan-2-ol Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(COC2=CC=C(C=C2)C3=CC=CC=C3)O)CC4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(COC2=CC=C(C=C2)C3=CC=CC=C3)O)CC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2S/c1-2-29-25(17-20-9-5-3-6-10-20)27-28-26(29)32-19-23(30)18-31-24-15-13-22(14-16-24)21-11-7-4-8-12-21/h3-16,23,30H,2,17-19H2,1H3