5-[[4-[2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethoxy]phenyl]methyl]thiolane-2,4-dione

Systemtic Name: 5-[[4-[2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)ethoxy]phenyl]methyl]thiolane-2,4-dione Openeye Name: 5-[[4-[2-(2-methyl-4-oxo-quinazolin-3-yl)ethoxy]phenyl]methyl]tetrahydrothiophene-2,4-dione CAS Name: 5-[[4-[2-(2-methyl-4-oxo-3-quinazolinyl)ethoxy]phenyl]methyl]thiolane-2,4-dione IUPAC Name: 5-[[4-[2-(2-methyl-4-oxoquinazolin-3-yl)ethoxy]phenyl]methyl]thiolane-2,4-dione Traditional Name: 5-[4-[2-(4-keto-2-methyl-quinazolin-3-yl)ethoxy]benzyl]tetrahydrothiophene-2,4-quinone Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCOC3=CC=C(C=C3)CC4C(=O)CC(=O)S4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCOC3=CC=C(C=C3)CC4C(=O)CC(=O)S4

InChI

InChI=1S/C22H20N2O4S/c1-14-23-18-5-3-2-4-17(18)22(27)24(14)10-11-28-16-8-6-15(7-9-16)12-20-19(25)13-21(26)29-20/h2-9,20H,10-13H2,1H3