2-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-butyl-quinazolin-4-one

Systemtic Name: 2-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-butyl-quinazolin-4-one Openeye Name: 2-[(7-bromo-2-oxo-chromen-4-yl)methylsulfanyl]-3-butyl-quinazolin-4-one CAS Name: 2-[(7-bromo-2-oxo-1-benzopyran-4-yl)methylthio]-3-butyl-4-quinazolinone IUPAC Name: 2-[(7-bromo-2-oxochromen-4-yl)methylsulfanyl]-3-butylquinazolin-4-one Traditional Name: 2-[(7-bromo-2-keto-chromen-4-yl)methylthio]-3-butyl-quinazolin-4-one Formula: C22H19BrN2O3S MolecularWeight: 471.36686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C22H19BrN2O3S/c1-2-3-10-25-21(27)17-6-4-5-7-18(17)24-22(25)29-13-14-11-20(26)28-19-12-15(23)8-9-16(14)19/h4-9,11-12H,2-3,10,13H2,1H3