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

Systemtic Name: 2-azanyl-4-chloranyl-7-[(3,4,5-trimethyl-1-oxidanidyl-pyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Openeye Name: 2-amino-4-chloro-7-[(3,4,5-trimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one CAS Name: 2-amino-4-chloro-7-[(3,4,5-trimethyl-1-oxido-2-pyridin-1-iumyl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one IUPAC Name: 2-amino-4-chloro-7-[(3,4,5-trimethyl-1-oxidopyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Traditional Name: 2-amino-4-chloro-7-[(3,4,5-trimethyl-1-oxido-pyridin-1-ium-2-yl)methyl]-6H-pyrrolo[2,3-d]pyrimidin-5-one Formula: C15H16ClN5O2 MolecularWeight: 333.77284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=C(C(=C1C)C)CN2CC(=O)C3=C2N=C(N=C3Cl)N)[O-]

Isomeric SMILES

CC1=C[N+](=C(C(=C1C)C)CN2CC(=O)C3=C2N=C(N=C3Cl)N)[O-]

InChI

InChI=1S/C15H16ClN5O2/c1-7-4-21(23)10(9(3)8(7)2)5-20-6-11(22)12-13(16)18-15(17)19-14(12)20/h4H,5-6H2,1-3H3,(H2,17,18,19)