(2R)-3-[2-[2-(4-methyl-2-propan-2-yl-phenoxy)ethylsulfanyl]benzimidazol-1-yl]propane-1,2-diol

Systemtic Name: (2R)-3-[2-[2-(4-methyl-2-propan-2-yl-phenoxy)ethylsulfanyl]benzimidazol-1-yl]propane-1,2-diol Openeye Name: (2R)-3-[2-[2-(2-isopropyl-4-methyl-phenoxy)ethylsulfanyl]benzimidazol-1-yl]propane-1,2-diol CAS Name: (2R)-3-[2-[2-(4-methyl-2-propan-2-ylphenoxy)ethylthio]-1-benzimidazolyl]propane-1,2-diol IUPAC Name: (2R)-3-[2-[2-(4-methyl-2-propan-2-ylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propane-1,2-diol Traditional Name: (2R)-3-[2-[2-(2-isopropyl-4-methyl-phenoxy)ethylthio]benzimidazol-1-yl]propane-1,2-diol Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC(CO)O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCSC2=NC3=CC=CC=C3N2C[C@H](CO)O)C(C)C

InChI

InChI=1S/C22H28N2O3S/c1-15(2)18-12-16(3)8-9-21(18)27-10-11-28-22-23-19-6-4-5-7-20(19)24(22)13-17(26)14-25/h4-9,12,15,17,25-26H,10-11,13-14H2,1-3H3/t17-/m1/s1