4-bromanyl-7-[(4,6-dimethoxy-3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: 4-bromanyl-7-[(4,6-dimethoxy-3,5-dimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: 4-bromo-7-[(4,6-dimethoxy-3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: 4-bromo-7-[(4,6-dimethoxy-3,5-dimethyl-1-oxido-2-pyridin-1-iumyl)methyl]-2-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: 4-bromo-7-[(4,6-dimethoxy-3,5-dimethyl-1-oxidopyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [4-bromo-7-[(4,6-dimethoxy-3,5-dimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]pyrrolo[2,3-d]pyrimidin-2-yl]amine Formula: C16H18BrN5O3 MolecularWeight: 408.24982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C([N+](=C1CN2C=CC3=C2N=C(N=C3Br)N)[O-])OC)C)OC

Isomeric SMILES

CC1=C(C(=C([N+](=C1CN2C=CC3=C2N=C(N=C3Br)N)[O-])OC)C)OC

InChI

InChI=1S/C16H18BrN5O3/c1-8-11(22(23)15(25-4)9(2)12(8)24-3)7-21-6-5-10-13(17)19-16(18)20-14(10)21/h5-6H,7H2,1-4H3,(H2,18,19,20)