2-[2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[3-[(4-fluorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[3-(4-fluorobenzyl)-4-keto-quinazolin-2-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C25H18FN3O3S MolecularWeight: 459.492123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=C(C=C5)F

InChI

InChI=1S/C25H18FN3O3S/c26-17-11-9-16(10-12-17)15-29-24(32)20-7-3-4-8-21(20)27-25(29)33-14-13-28-22(30)18-5-1-2-6-19(18)23(28)31/h1-12H,13-15H2