2-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 2-[(7-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 2-[(7-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one CAS Name: 2-[(7-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-3-propyl-4-quinazolinone IUPAC Name: 2-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 2-[(7-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-3-propyl-quinazolin-4-one Formula: C20H17BrN4O2S MolecularWeight: 457.34358

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)N4C=C(C=CC4=N3)Br

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)N4C=C(C=CC4=N3)Br

InChI

InChI=1S/C20H17BrN4O2S/c1-2-9-24-19(27)15-5-3-4-6-16(15)23-20(24)28-12-14-10-18(26)25-11-13(21)7-8-17(25)22-14/h3-8,10-11H,2,9,12H2,1H3