5-(2-tert-butyl-4,5-dimethyl-phenyl)sulfanyl-6-oxidanyl-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one

Systemtic Name: 5-(2-tert-butyl-4,5-dimethyl-phenyl)sulfanyl-6-oxidanyl-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one Openeye Name: 5-(2-tert-butyl-4,5-dimethyl-phenyl)sulfanyl-6-hydroxy-2-isopropyl-2-[2-(3-thienyl)ethyl]-3H-pyran-4-one CAS Name: 5-[(2-tert-butyl-4,5-dimethylphenyl)thio]-6-hydroxy-2-propan-2-yl-2-[2-(3-thiophenyl)ethyl]-3H-pyran-4-one IUPAC Name: 5-(2-tert-butyl-4,5-dimethylphenyl)sulfanyl-6-hydroxy-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one Traditional Name: 5-[(2-tert-butyl-4,5-dimethyl-phenyl)thio]-6-hydroxy-2-isopropyl-2-[2-(3-thienyl)ethyl]-3H-pyran-4-one Formula: C26H34O3S2 MolecularWeight: 458.67636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)SC2=C(OC(CC2=O)(CCC3=CSC=C3)C(C)C)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C)SC2=C(OC(CC2=O)(CCC3=CSC=C3)C(C)C)O)C(C)(C)C

InChI

InChI=1S/C26H34O3S2/c1-16(2)26(10-8-19-9-11-30-15-19)14-21(27)23(24(28)29-26)31-22-13-18(4)17(3)12-20(22)25(5,6)7/h9,11-13,15-16,28H,8,10,14H2,1-7H3