(6R)-6-[2-(4-aminophenyl)ethyl]-3-(2-tert-butyl-6-methyl-4-oxidanyl-phenyl)sulfanyl-4-oxidanyl-6-propan-2-yl-3H-pyran-2-one

Systemtic Name: (6R)-6-[2-(4-aminophenyl)ethyl]-3-(2-tert-butyl-6-methyl-4-oxidanyl-phenyl)sulfanyl-4-oxidanyl-6-propan-2-yl-3H-pyran-2-one Openeye Name: (6R)-6-[2-(4-aminophenyl)ethyl]-3-(2-tert-butyl-4-hydroxy-6-methyl-phenyl)sulfanyl-4-hydroxy-6-isopropyl-3H-pyran-2-one CAS Name: (6R)-6-[2-(4-aminophenyl)ethyl]-3-[(2-tert-butyl-4-hydroxy-6-methylphenyl)thio]-4-hydroxy-6-propan-2-yl-3H-pyran-2-one IUPAC Name: (6R)-6-[2-(4-aminophenyl)ethyl]-3-(2-tert-butyl-4-hydroxy-6-methylphenyl)sulfanyl-4-hydroxy-6-propan-2-yl-3H-pyran-2-one Traditional Name: (6R)-6-[2-(4-aminophenyl)ethyl]-3-[(2-tert-butyl-4-hydroxy-6-methyl-phenyl)thio]-4-hydroxy-6-isopropyl-3H-pyran-2-one Formula: C27H35NO4S MolecularWeight: 469.6361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1SC2C(=CC(OC2=O)(CCC3=CC=C(C=C3)N)C(C)C)O)C(C)(C)C)O

Isomeric SMILES

CC1=CC(=CC(=C1SC2C(=C[C@@](OC2=O)(CCC3=CC=C(C=C3)N)C(C)C)O)C(C)(C)C)O

InChI

InChI=1S/C27H35NO4S/c1-16(2)27(12-11-18-7-9-19(28)10-8-18)15-22(30)24(25(31)32-27)33-23-17(3)13-20(29)14-21(23)26(4,5)6/h7-10,13-16,24,29-30H,11-12,28H2,1-6H3/t24?,27-/m0/s1