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

Systemtic Name: 2-[2-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[4-keto-3-(2-methoxyphenyl)quinazolin-2-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C25H19N3O4S MolecularWeight: 457.50106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H19N3O4S/c1-32-21-13-7-6-12-20(21)28-24(31)18-10-4-5-11-19(18)26-25(28)33-15-14-27-22(29)16-8-2-3-9-17(16)23(27)30/h2-13H,14-15H2,1H3