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

Systemtic Name: 3-cyclopropyl-2-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-cyclopropyl-2-[(7-hydroxy-2-oxo-chromen-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-cyclopropyl-2-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 3-cyclopropyl-2-[(7-hydroxy-2-oxochromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-cyclopropyl-2-[(7-hydroxy-2-keto-chromen-4-yl)methylthio]quinazolin-4-one Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)O

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)O

InChI

InChI=1S/C21H16N2O4S/c24-14-7-8-15-12(9-19(25)27-18(15)10-14)11-28-21-22-17-4-2-1-3-16(17)20(26)23(21)13-5-6-13/h1-4,7-10,13,24H,5-6,11H2