6-[[4,5-bis(4-propan-2-ylphenyl)-1H-imidazol-2-yl]sulfanylmethyl]-4-methyl-4-oxidanyl-oxan-2-one

Systemtic Name: 6-[[4,5-bis(4-propan-2-ylphenyl)-1H-imidazol-2-yl]sulfanylmethyl]-4-methyl-4-oxidanyl-oxan-2-one Openeye Name: 6-[[4,5-bis(4-isopropylphenyl)-1H-imidazol-2-yl]sulfanylmethyl]-4-hydroxy-4-methyl-tetrahydropyran-2-one CAS Name: 6-[[[4,5-bis(4-propan-2-ylphenyl)-1H-imidazol-2-yl]thio]methyl]-4-hydroxy-4-methyl-2-oxanone IUPAC Name: 6-[[4,5-bis(4-propan-2-ylphenyl)-1H-imidazol-2-yl]sulfanylmethyl]-4-hydroxy-4-methyloxan-2-one Traditional Name: 6-[[[4,5-bis(p-cumenyl)-1H-imidazol-2-yl]thio]methyl]-4-hydroxy-4-methyl-tetrahydropyran-2-one Formula: C28H34N2O3S MolecularWeight: 478.64616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(N=C(N2)SCC3CC(CC(=O)O3)(C)O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(N=C(N2)SCC3CC(CC(=O)O3)(C)O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C28H34N2O3S/c1-17(2)19-6-10-21(11-7-19)25-26(22-12-8-20(9-13-22)18(3)4)30-27(29-25)34-16-23-14-28(5,32)15-24(31)33-23/h6-13,17-18,23,32H,14-16H2,1-5H3,(H,29,30)