3-butan-2-yl-2-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-butan-2-yl-2-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 2-[(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-sec-butyl-quinazolin-4-one CAS Name: 3-butan-2-yl-2-[(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 3-butan-2-yl-2-[(7-hydroxy-8-methyl-2-oxochromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 2-[(7-hydroxy-2-keto-8-methyl-chromen-4-yl)methylthio]-3-sec-butyl-quinazolin-4-one Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4C)O

Isomeric SMILES

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4C)O

InChI

InChI=1S/C23H22N2O4S/c1-4-13(2)25-22(28)17-7-5-6-8-18(17)24-23(25)30-12-15-11-20(27)29-21-14(3)19(26)10-9-16(15)21/h5-11,13,26H,4,12H2,1-3H3