1-[4-[3-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-2-oxidanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[3-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-2-oxidanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-hydroxy-3-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-hydroxy-3-[(1-methyl-5-phenyl-2-imidazolyl)thio]propoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-hydroxy-3-(1-methyl-5-phenylimidazol-2-yl)sulfanylpropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-hydroxy-3-[(1-methyl-5-phenyl-imidazol-2-yl)thio]propoxy]phenyl]propan-1-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CSC2=NC=C(N2C)C3=CC=CC=C3)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CSC2=NC=C(N2C)C3=CC=CC=C3)O

InChI

InChI=1S/C22H24N2O3S/c1-3-21(26)17-9-11-19(12-10-17)27-14-18(25)15-28-22-23-13-20(24(22)2)16-7-5-4-6-8-16/h4-13,18,25H,3,14-15H2,1-2H3