4-[1-[3,5-bis(oxidanylidene)-5-phenyl-pentan-2-yl]sulfanylcyclohexyl]sulfanyl-1-phenyl-pentane-1,3-dione

Systemtic Name: 4-[1-[3,5-bis(oxidanylidene)-5-phenyl-pentan-2-yl]sulfanylcyclohexyl]sulfanyl-1-phenyl-pentane-1,3-dione Openeye Name: 4-[1-(1-methyl-2,4-dioxo-4-phenyl-butyl)sulfanylcyclohexyl]sulfanyl-1-phenyl-pentane-1,3-dione CAS Name: 4-[[1-[(3,5-dioxo-5-phenylpentan-2-yl)thio]cyclohexyl]thio]-1-phenylpentane-1,3-dione IUPAC Name: 4-[1-(3,5-dioxo-5-phenylpentan-2-yl)sulfanylcyclohexyl]sulfanyl-1-phenylpentane-1,3-dione Traditional Name: 4-[[1-[(2,4-diketo-1-methyl-4-phenyl-butyl)thio]cyclohexyl]thio]-1-phenyl-pentane-1,3-dione Formula: C28H32O4S2 MolecularWeight: 496.68128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)CC(=O)C1=CC=CC=C1)SC2(CCCCC2)SC(C)C(=O)CC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)CC(=O)C1=CC=CC=C1)SC2(CCCCC2)SC(C)C(=O)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H32O4S2/c1-20(24(29)18-26(31)22-12-6-3-7-13-22)33-28(16-10-5-11-17-28)34-21(2)25(30)19-27(32)23-14-8-4-9-15-23/h3-4,6-9,12-15,20-21H,5,10-11,16-19H2,1-2H3