6-bromanyl-2-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 6-bromo-2-[(6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propyl-quinazolin-4-one CAS Name: 6-bromo-2-[(6-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]-3-propyl-4-quinazolinone IUPAC Name: 6-bromo-2-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 6-bromo-2-[(4-keto-6-methyl-pyrido[1,2-a]pyrimidin-2-yl)methylthio]-3-propyl-quinazolin-4-one Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrN4O2S/c1-3-9-25-20(28)16-10-14(22)7-8-17(16)24-21(25)29-12-15-11-19(27)26-13(2)5-4-6-18(26)23-15/h4-8,10-11H,3,9,12H2,1-2H3