2-[4-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylbutyl]isoindole-1,3-dione Openeye Name: 2-[4-[7-chloro-3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanylbutyl]isoindoline-1,3-dione CAS Name: 2-[4-[[7-chloro-3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[7-chloro-3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylbutyl]isoindole-1,3-dione Traditional Name: 2-[4-[[7-chloro-4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]butyl]isoindoline-1,3-quinone Formula: C24H24ClN3O4S MolecularWeight: 485.98306

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H24ClN3O4S/c1-32-13-6-12-28-23(31)19-10-9-16(25)15-20(19)26-24(28)33-14-5-4-11-27-21(29)17-7-2-3-8-18(17)22(27)30/h2-3,7-10,15H,4-6,11-14H2,1H3