3-[(4-fluorophenyl)methyl]-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[(4-fluorophenyl)methyl]-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-[(4-fluorophenyl)methyl]-2-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-[(4-fluorophenyl)methyl]-2-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 3-[(4-fluorophenyl)methyl]-2-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(4-fluorobenzyl)-2-[(2-keto-7-methyl-chromen-4-yl)methylthio]quinazolin-4-one Formula: C26H19FN2O3S MolecularWeight: 458.504063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=C(C=C5)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3CC5=CC=C(C=C5)F

InChI

InChI=1S/C26H19FN2O3S/c1-16-6-11-20-18(13-24(30)32-23(20)12-16)15-33-26-28-22-5-3-2-4-21(22)25(31)29(26)14-17-7-9-19(27)10-8-17/h2-13H,14-15H2,1H3