6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-3-methyl-3,5-bis(oxidanyl)hexanoate

Systemtic Name: 6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-3-methyl-3,5-bis(oxidanyl)hexanoate Openeye Name: 6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-3,5-dihydroxy-3-methyl-hexanoate CAS Name: 6-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-3,5-dihydroxy-3-methylhexanoate IUPAC Name: 6-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-3,5-dihydroxy-3-methylhexanoate Traditional Name: 6-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-3,5-dihydroxy-3-methyl-hexanoate Formula: C22H23N2O4S- MolecularWeight: 411.49402

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)O)(CC(=O)[O-])O

Isomeric SMILES

CC(CC(CSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)O)(CC(=O)[O-])O

InChI

InChI=1S/C22H24N2O4S/c1-22(28,13-18(26)27)12-17(25)14-29-21-23-19(15-8-4-2-5-9-15)20(24-21)16-10-6-3-7-11-16/h2-11,17,25,28H,12-14H2,1H3,(H,23,24)(H,26,27)/p-1