N-tert-butyl-1-[(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-tert-butyl-1-[(6-oxidanyl-4-oxidanylidene-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-tert-butyl-1-[(6-hydroxy-4-oxo-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclohexanecarboxamide CAS Name: N-tert-butyl-1-[[6-hydroxy-4-oxo-5-(phenethylthio)-2-phenyl-3H-pyran-2-yl]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-tert-butyl-1-[(6-hydroxy-4-oxo-5-phenethylsulfanyl-2-phenyl-3H-pyran-2-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-tert-butyl-1-[[6-hydroxy-4-keto-5-(phenethylthio)-2-phenyl-3H-pyran-2-yl]methyl]cyclohexanecarboxamide Formula: C31H39NO4S MolecularWeight: 521.71066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1(CCCCC1)CC2(CC(=O)C(=C(O2)O)SCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC(=O)C1(CCCCC1)CC2(CC(=O)C(=C(O2)O)SCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H39NO4S/c1-29(2,3)32-28(35)30(18-11-6-12-19-30)22-31(24-15-9-5-10-16-24)21-25(33)26(27(34)36-31)37-20-17-23-13-7-4-8-14-23/h4-5,7-10,13-16,34H,6,11-12,17-22H2,1-3H3,(H,32,35)