3-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]thieno[3,2-d]pyrimidin-4-one Traditional Name: 3-[(7-bromo-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]thieno[3,2-d]pyrimidin-4-one Formula: C15H10BrN4O2S+ MolecularWeight: 390.2345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=[N+](C=C1Br)C(=O)C=C(N2)CN3C=NC4=C(C3=O)SC=C4

Isomeric SMILES

C1=CC2=[N+](C=C1Br)C(=O)C=C(N2)CN3C=NC4=C(C3=O)SC=C4

InChI

InChI=1S/C15H9BrN4O2S/c16-9-1-2-12-18-10(5-13(21)20(12)6-9)7-19-8-17-11-3-4-23-14(11)15(19)22/h1-6,8H,7H2/p+1