1-imidazol-1-yl-3-methyl-2-[4-(phenylsulfinyl)phenyl]heptan-2-ol

Systemtic Name: 1-imidazol-1-yl-3-methyl-2-[4-(phenylsulfinyl)phenyl]heptan-2-ol Openeye Name: 2-[4-(benzenesulfinyl)phenyl]-1-imidazol-1-yl-3-methyl-heptan-2-ol CAS Name: 2-[4-(benzenesulfinyl)phenyl]-1-(1-imidazolyl)-3-methyl-2-heptanol IUPAC Name: 2-[4-(benzenesulfinyl)phenyl]-1-imidazol-1-yl-3-methylheptan-2-ol Traditional Name: 2-[4-(benzenesulfinyl)phenyl]-1-imidazol-1-yl-3-methyl-heptan-2-ol Formula: C23H28N2O2S MolecularWeight: 396.54562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(CN1C=CN=C1)(C2=CC=C(C=C2)S(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCCCC(C)C(CN1C=CN=C1)(C2=CC=C(C=C2)S(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C23H28N2O2S/c1-3-4-8-19(2)23(26,17-25-16-15-24-18-25)20-11-13-22(14-12-20)28(27)21-9-6-5-7-10-21/h5-7,9-16,18-19,26H,3-4,8,17H2,1-2H3