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

Systemtic Name: 5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-2-cyclopentyl-6-oxidanyl-2-phenethyl-3H-pyran-4-one Openeye Name: 5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-2-cyclopentyl-6-hydroxy-2-phenethyl-3H-pyran-4-one CAS Name: 5-[(6-tert-butyl-1H-indol-5-yl)thio]-2-cyclopentyl-6-hydroxy-2-phenethyl-3H-pyran-4-one IUPAC Name: 5-[(6-tert-butyl-1H-indol-5-yl)sulfanyl]-2-cyclopentyl-6-hydroxy-2-phenethyl-3H-pyran-4-one Traditional Name: 5-[(6-tert-butyl-1H-indol-5-yl)thio]-2-cyclopentyl-6-hydroxy-2-phenethyl-3H-pyran-4-one Formula: C30H35NO3S MolecularWeight: 489.6688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C2C=CNC2=C1)SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C5CCCC5)O

Isomeric SMILES

CC(C)(C)C1=C(C=C2C=CNC2=C1)SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C5CCCC5)O

InChI

InChI=1S/C30H35NO3S/c1-29(2,3)23-18-24-21(14-16-31-24)17-26(23)35-27-25(32)19-30(34-28(27)33,22-11-7-8-12-22)15-13-20-9-5-4-6-10-20/h4-6,9-10,14,16-18,22,31,33H,7-8,11-13,15,19H2,1-3H3