(2S)-1-(4-phenylmethoxyphenoxy)-3-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]propan-2-ol

Systemtic Name: (2S)-1-(4-phenylmethoxyphenoxy)-3-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]propan-2-ol Openeye Name: (2S)-1-(4-benzyloxyphenoxy)-3-(2-benzylsulfanylbenzimidazol-1-yl)propan-2-ol CAS Name: (2S)-1-(4-phenylmethoxyphenoxy)-3-[2-(phenylmethylthio)-1-benzimidazolyl]-2-propanol IUPAC Name: (2S)-1-(2-benzylsulfanylbenzimidazol-1-yl)-3-(4-phenylmethoxyphenoxy)propan-2-ol Traditional Name: (2S)-1-(4-benzoxyphenoxy)-3-[2-(benzylthio)benzimidazol-1-yl]propan-2-ol Formula: C30H28N2O3S MolecularWeight: 496.61992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCC(CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OC[C@H](CN3C4=CC=CC=C4N=C3SCC5=CC=CC=C5)O

InChI

InChI=1S/C30H28N2O3S/c33-25(21-35-27-17-15-26(16-18-27)34-20-23-9-3-1-4-10-23)19-32-29-14-8-7-13-28(29)31-30(32)36-22-24-11-5-2-6-12-24/h1-18,25,33H,19-22H2/t25-/m0/s1