6-chloranyl-3-(2-methylpropyl)-2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 6-chloranyl-3-(2-methylpropyl)-2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 6-chloro-2-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]-3-isobutyl-quinazolin-4-one CAS Name: 6-chloro-2-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-3-(2-methylpropyl)-4-quinazolinone IUPAC Name: 6-chloro-2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]-3-(2-methylpropyl)quinazolin-4-one Traditional Name: 6-chloro-2-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]-3-isobutyl-quinazolin-4-one Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C22H19ClN2O4S/c1-12(2)10-25-21(28)17-8-14(23)3-6-18(17)24-22(25)30-11-13-7-20(27)29-19-9-15(26)4-5-16(13)19/h3-9,12,26H,10-11H2,1-2H3