2-[(3-bromanyl-5,7-dimethyl-imidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(3-bromanyl-5,7-dimethyl-imidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(3-bromo-5,7-dimethyl-imidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[(3-bromo-5,7-dimethyl-2-imidazo[1,2-a]pyrimidinyl)methylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[(3-bromo-5,7-dimethyl-imidazo[1,2-a]pyrimidin-2-yl)methylthio]-6-methyl-pyrimidin-4-olate Formula: C14H13BrN5OS- MolecularWeight: 379.25492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=C(N3C(=CC(=NC3=N2)C)C)Br)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=C(N3C(=CC(=NC3=N2)C)C)Br)[O-]

InChI

InChI=1S/C14H14BrN5OS/c1-7-4-9(3)20-12(15)10(18-13(20)16-7)6-22-14-17-8(2)5-11(21)19-14/h4-5H,6H2,1-3H3,(H,17,19,21)/p-1