6-fluoranyl-5-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-4-phenylmethoxy-isoindole-1,3-dione

Systemtic Name: 6-fluoranyl-5-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-4-phenylmethoxy-isoindole-1,3-dione Openeye Name: 4-benzyloxy-6-fluoro-5-[3-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanyl-isoindoline-1,3-dione CAS Name: 6-fluoro-5-[[3-(4-methoxy-4-oxanyl)phenyl]thio]-4-phenylmethoxyisoindole-1,3-dione IUPAC Name: 6-fluoro-5-[3-(4-methoxyoxan-4-yl)phenyl]sulfanyl-4-phenylmethoxyisoindole-1,3-dione Traditional Name: 4-benzoxy-6-fluoro-5-[[3-(4-methoxytetrahydropyran-4-yl)phenyl]thio]isoindoline-1,3-quinone Formula: C27H24FNO5S MolecularWeight: 493.546563

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCOCC1)C2=CC(=CC=C2)SC3=C(C=C4C(=C3OCC5=CC=CC=C5)C(=O)NC4=O)F

Isomeric SMILES

COC1(CCOCC1)C2=CC(=CC=C2)SC3=C(C=C4C(=C3OCC5=CC=CC=C5)C(=O)NC4=O)F

InChI

InChI=1S/C27H24FNO5S/c1-32-27(10-12-33-13-11-27)18-8-5-9-19(14-18)35-24-21(28)15-20-22(26(31)29-25(20)30)23(24)34-16-17-6-3-2-4-7-17/h2-9,14-15H,10-13,16H2,1H3,(H,29,30,31)