1-(1H-imidazol-2-yl)-3,3-dimethyl-1-(4-phenylsulfanylphenoxy)butan-2-ol

Systemtic Name: 1-(1H-imidazol-2-yl)-3,3-dimethyl-1-(4-phenylsulfanylphenoxy)butan-2-ol Openeye Name: 1-(1H-imidazol-2-yl)-3,3-dimethyl-1-(4-phenylsulfanylphenoxy)butan-2-ol CAS Name: 1-(1H-imidazol-2-yl)-3,3-dimethyl-1-[4-(phenylthio)phenoxy]-2-butanol IUPAC Name: 1-(1H-imidazol-2-yl)-3,3-dimethyl-1-(4-phenylsulfanylphenoxy)butan-2-ol Traditional Name: 1-(1H-imidazol-2-yl)-3,3-dimethyl-1-[4-(phenylthio)phenoxy]butan-2-ol Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(C1=NC=CN1)OC2=CC=C(C=C2)SC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)C(C(C1=NC=CN1)OC2=CC=C(C=C2)SC3=CC=CC=C3)O

InChI

InChI=1S/C21H24N2O2S/c1-21(2,3)19(24)18(20-22-13-14-23-20)25-15-9-11-17(12-10-15)26-16-7-5-4-6-8-16/h4-14,18-19,24H,1-3H3,(H,22,23)