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

Systemtic Name: 2-[2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]ethyl]isoindoline-1,3-quinone Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H23N3O3S/c1-15(2)11-12-26-22(29)18-9-5-6-10-19(18)24-23(26)30-14-13-25-20(27)16-7-3-4-8-17(16)21(25)28/h3-10,15H,11-14H2,1-2H3