2-[4-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutyl]isoindole-1,3-dione Openeye Name: 2-[4-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanylbutyl]isoindoline-1,3-dione CAS Name: 2-[4-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylbutyl]isoindole-1,3-dione Traditional Name: 2-[4-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]butyl]isoindoline-1,3-quinone Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1SCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1SCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H25N3O4S/c1-31-15-8-14-27-23(30)19-11-4-5-12-20(19)25-24(27)32-16-7-6-13-26-21(28)17-9-2-3-10-18(17)22(26)29/h2-5,9-12H,6-8,13-16H2,1H3