6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-2-[2-(1H-pyrrol-2-yl)ethyl]-3H-pyran-4-one

Systemtic Name: 6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-2-[2-(1H-pyrrol-2-yl)ethyl]-3H-pyran-4-one Openeye Name: 5-benzylsulfanyl-6-hydroxy-2-phenyl-2-[2-(1H-pyrrol-2-yl)ethyl]-3H-pyran-4-one CAS Name: 6-hydroxy-2-phenyl-5-(phenylmethylthio)-2-[2-(1H-pyrrol-2-yl)ethyl]-3H-pyran-4-one IUPAC Name: 5-benzylsulfanyl-6-hydroxy-2-phenyl-2-[2-(1H-pyrrol-2-yl)ethyl]-3H-pyran-4-one Traditional Name: 5-(benzylthio)-6-hydroxy-2-phenyl-2-[2-(1H-pyrrol-2-yl)ethyl]-3H-pyran-4-one Formula: C24H23NO3S MolecularWeight: 405.50932

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(OC1(CCC2=CC=CN2)C3=CC=CC=C3)O)SCC4=CC=CC=C4

Isomeric SMILES

C1C(=O)C(=C(OC1(CCC2=CC=CN2)C3=CC=CC=C3)O)SCC4=CC=CC=C4

InChI

InChI=1S/C24H23NO3S/c26-21-16-24(19-10-5-2-6-11-19,14-13-20-12-7-15-25-20)28-23(27)22(21)29-17-18-8-3-1-4-9-18/h1-12,15,25,27H,13-14,16-17H2