(2R)-1-(4-bromanylphenoxy)-3-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(4-bromanylphenoxy)-3-[2-(phenylmethylsulfanyl)benzimidazol-1-yl]propan-2-ol Openeye Name: (2R)-1-(2-benzylsulfanylbenzimidazol-1-yl)-3-(4-bromophenoxy)propan-2-ol CAS Name: (2R)-1-(4-bromophenoxy)-3-[2-(phenylmethylthio)-1-benzimidazolyl]-2-propanol IUPAC Name: (2R)-1-(2-benzylsulfanylbenzimidazol-1-yl)-3-(4-bromophenoxy)propan-2-ol Traditional Name: (2R)-1-[2-(benzylthio)benzimidazol-1-yl]-3-(4-bromophenoxy)propan-2-ol Formula: C23H21BrN2O2S MolecularWeight: 469.39404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2CC(COC4=CC=C(C=C4)Br)O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2C[C@H](COC4=CC=C(C=C4)Br)O

InChI

InChI=1S/C23H21BrN2O2S/c24-18-10-12-20(13-11-18)28-15-19(27)14-26-22-9-5-4-8-21(22)25-23(26)29-16-17-6-2-1-3-7-17/h1-13,19,27H,14-16H2/t19-/m1/s1