2-[(2S)-1-fluoranyl-3-phenyl-1-phenylsulfanyl-propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2S)-1-fluoranyl-3-phenyl-1-phenylsulfanyl-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[(1S)-1-benzyl-2-fluoro-2-phenylsulfanyl-ethyl]isoindoline-1,3-dione CAS Name: 2-[(2S)-1-fluoro-3-phenyl-1-(phenylthio)propan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[(2S)-1-fluoro-3-phenyl-1-phenylsulfanylpropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[(1S)-1-benzyl-2-fluoro-2-(phenylthio)ethyl]isoindoline-1,3-quinone Formula: C23H18FNO2S MolecularWeight: 391.457923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(F)SC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(F)SC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H18FNO2S/c24-21(28-17-11-5-2-6-12-17)20(15-16-9-3-1-4-10-16)25-22(26)18-13-7-8-14-19(18)23(25)27/h1-14,20-21H,15H2/t20-,21?/m0/s1