2-azanyl-4-bromanyl-7-[(4-methoxy-3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one

Systemtic Name: 2-azanyl-4-bromanyl-7-[(4-methoxy-3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Openeye Name: 2-amino-4-bromo-7-[(4-methoxy-3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one CAS Name: 2-amino-4-bromo-7-[(4-methoxy-3,5-dimethyl-1-oxido-2-pyridin-1-iumyl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one IUPAC Name: 2-amino-4-bromo-7-[(4-methoxy-3,5-dimethyl-1-oxidopyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Traditional Name: 2-amino-4-bromo-7-[(4-methoxy-3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Formula: C15H16BrN5O3 MolecularWeight: 394.22324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=C(C(=C1OC)C)CN2CC(=O)C3=C2N=C(N=C3Br)N)[O-]

Isomeric SMILES

CC1=C[N+](=C(C(=C1OC)C)CN2CC(=O)C3=C2N=C(N=C3Br)N)[O-]

InChI

InChI=1S/C15H16BrN5O3/c1-7-4-21(23)9(8(2)12(7)24-3)5-20-6-10(22)11-13(16)18-15(17)19-14(11)20/h4H,5-6H2,1-3H3,(H2,17,18,19)