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

Systemtic Name: 2-[2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H23N3O3S/c1-17(2)18-9-6-8-14-23(18)30-26(33)21-12-5-7-13-22(21)28-27(30)34-16-15-29-24(31)19-10-3-4-11-20(19)25(29)32/h3-14,17H,15-16H2,1-2H3