3-(2,5-ditert-butylphenyl)sulfanyl-2-oxidanyl-6-phenyl-pyran-4-one

Systemtic Name: 3-(2,5-ditert-butylphenyl)sulfanyl-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-(2,5-ditert-butylphenyl)sulfanyl-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-[(2,5-ditert-butylphenyl)thio]-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-(2,5-ditert-butylphenyl)sulfanyl-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[(2,5-ditert-butylphenyl)thio]-2-hydroxy-6-phenyl-pyran-4-one Formula: C25H28O3S MolecularWeight: 408.55302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)C(C)(C)C)SC2=C(OC(=CC2=O)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)C(C)(C)C)SC2=C(OC(=CC2=O)C3=CC=CC=C3)O

InChI

InChI=1S/C25H28O3S/c1-24(2,3)17-12-13-18(25(4,5)6)21(14-17)29-22-19(26)15-20(28-23(22)27)16-10-8-7-9-11-16/h7-15,27H,1-6H3