7-bromanyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-bromanyl-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-bromo-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-bromo-2-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-bromo-2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-bromo-2-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C20H13BrN6OS MolecularWeight: 465.32582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC(=O)N5C=C(C=CC5=N4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC(=O)N5C=C(C=CC5=N4)Br

InChI

InChI=1S/C20H13BrN6OS/c21-13-6-7-17-25-14(8-18(28)26(17)10-13)11-29-20-16-9-24-27(19(16)22-12-23-20)15-4-2-1-3-5-15/h1-10,12H,11H2