4-bromanyl-7-[(4-bromanyl-3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: 4-bromanyl-7-[(4-bromanyl-3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: 4-bromo-7-[(4-bromo-3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: 4-bromo-7-[(4-bromo-3,5-dimethyl-1-oxido-2-pyridin-1-iumyl)methyl]-2-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 4-bromo-7-[(4-bromo-3,5-dimethyl-1-oxidopyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [4-bromo-7-[(4-bromo-3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-yl]amine Formula: C14H13Br2N5O MolecularWeight: 427.09392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=C(C(=C1Br)C)CN2C=CC3=C2N=C(N=C3Br)N)[O-]

Isomeric SMILES

CC1=C[N+](=C(C(=C1Br)C)CN2C=CC3=C2N=C(N=C3Br)N)[O-]

InChI

InChI=1S/C14H13Br2N5O/c1-7-5-21(22)10(8(2)11(7)15)6-20-4-3-9-12(16)18-14(17)19-13(9)20/h3-5H,6H2,1-2H3,(H2,17,18,19)