2-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C24H16FN3O2S MolecularWeight: 429.466143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2SCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2SCCN3C(=O)C4=CC=CC=C4C3=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C24H16FN3O2S/c25-16-11-9-15(10-12-16)21-17-5-1-2-6-18(17)22(27-26-21)31-14-13-28-23(29)19-7-3-4-8-20(19)24(28)30/h1-12H,13-14H2