5-[bis(fluoranyl)-phenylsulfanyl-methyl]-5-oxidanyl-1-[(E)-4-phenylbut-3-enyl]pyrrolidin-2-one

Systemtic Name: 5-[bis(fluoranyl)-phenylsulfanyl-methyl]-5-oxidanyl-1-[(E)-4-phenylbut-3-enyl]pyrrolidin-2-one Openeye Name: 5-[difluoro(phenylsulfanyl)methyl]-5-hydroxy-1-[(E)-4-phenylbut-3-enyl]pyrrolidin-2-one CAS Name: 5-[difluoro-(phenylthio)methyl]-5-hydroxy-1-[(E)-4-phenylbut-3-enyl]-2-pyrrolidinone IUPAC Name: 5-[difluoro(phenylsulfanyl)methyl]-5-hydroxy-1-[(E)-4-phenylbut-3-enyl]pyrrolidin-2-one Traditional Name: 5-[difluoro-(phenylthio)methyl]-5-hydroxy-1-[(E)-4-phenylbut-3-enyl]-2-pyrrolidone Formula: C21H21F2NO2S MolecularWeight: 389.458746

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1=O)CCC=CC2=CC=CC=C2)(C(F)(F)SC3=CC=CC=C3)O

Isomeric SMILES

C1CC(N(C1=O)CC/C=C/C2=CC=CC=C2)(C(F)(F)SC3=CC=CC=C3)O

InChI

InChI=1S/C21H21F2NO2S/c22-21(23,27-18-12-5-2-6-13-18)20(26)15-14-19(25)24(20)16-8-7-11-17-9-3-1-4-10-17/h1-7,9-13,26H,8,14-16H2/b11-7+