5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-2-[2-[2-(hydroxymethyl)thiophen-3-yl]ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one

Systemtic Name: 5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-2-[2-[2-(hydroxymethyl)thiophen-3-yl]ethyl]-6-oxidanyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: 5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-6-hydroxy-2-[2-[2-(hydroxymethyl)-3-thienyl]ethyl]-2-isopropyl-3H-pyran-4-one CAS Name: 5-[(6-tert-butyl-1H-indol-5-yl)thio]-6-hydroxy-2-[2-[2-(hydroxymethyl)-3-thiophenyl]ethyl]-2-propan-2-yl-3H-pyran-4-one IUPAC Name: 5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-6-hydroxy-2-[2-[2-(hydroxymethyl)thiophen-3-yl]ethyl]-2-propan-2-yl-3H-pyran-4-one Traditional Name: 5-[(6-tert-butyl-1H-indol-5-yl)thio]-6-hydroxy-2-isopropyl-2-[2-(2-methylol-3-thienyl)ethyl]-3H-pyran-4-one Formula: C27H33NO4S2 MolecularWeight: 499.68522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC(=O)C(=C(O1)O)SC2=C(C=C3C(=C2)C=CN3)C(C)(C)C)CCC4=C(SC=C4)CO

Isomeric SMILES

CC(C)C1(CC(=O)C(=C(O1)O)SC2=C(C=C3C(=C2)C=CN3)C(C)(C)C)CCC4=C(SC=C4)CO

InChI

InChI=1S/C27H33NO4S2/c1-16(2)27(9-6-17-8-11-33-23(17)15-29)14-21(30)24(25(31)32-27)34-22-12-18-7-10-28-20(18)13-19(22)26(3,4)5/h7-8,10-13,16,28-29,31H,6,9,14-15H2,1-5H3