8-bromanyl-9-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-bromanyl-9-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-bromo-9-[(7-chloro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-bromo-9-[(7-chloro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-bromo-9-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-bromo-9-[(7-chloro-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,3-dimethyl-xanthine Formula: C16H12BrClN6O3 MolecularWeight: 451.66188

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC3=CC(=O)N4C=C(C=CC4=N3)Cl)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C(N2CC3=CC(=O)N4C=C(C=CC4=N3)Cl)Br

InChI

InChI=1S/C16H12BrClN6O3/c1-21-13-12(14(26)22(2)16(21)27)20-15(17)24(13)7-9-5-11(25)23-6-8(18)3-4-10(23)19-9/h3-6H,7H2,1-2H3