5-[(3-tert-butyl-1-benzothiophen-2-yl)sulfanyl]-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 5-[(3-tert-butyl-1-benzothiophen-2-yl)sulfanyl]-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one Openeye Name: 5-(3-tert-butylbenzothiophen-2-yl)sulfanyl-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one CAS Name: 5-[(3-tert-butyl-1-benzothiophen-2-yl)thio]-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one IUPAC Name: 5-[(3-tert-butyl-1-benzothiophen-2-yl)sulfanyl]-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Traditional Name: 5-[(3-tert-butylbenzothiophen-2-yl)thio]-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Formula: C31H30O3S2 MolecularWeight: 514.6981

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC2=CC=CC=C21)SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CC(C)(C)C1=C(SC2=CC=CC=C21)SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C31H30O3S2/c1-30(2,3)26-23-16-10-11-17-25(23)35-29(26)36-27-24(32)20-31(34-28(27)33,22-14-8-5-9-15-22)19-18-21-12-6-4-7-13-21/h4-17,33H,18-20H2,1-3H3