1,3-dimethyl-7-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[(6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]purine-2,6-dione Openeye Name: 1,3-dimethyl-7-[(6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]purine-2,6-dione CAS Name: 1,3-dimethyl-7-[(6-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]purine-2,6-dione Traditional Name: 7-[(4-keto-6-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl]-1,3-dimethyl-xanthine Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=NC(=CC(=O)N12)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

Isomeric SMILES

CC1=CC=CC2=NC(=CC(=O)N12)CN3C=NC4=C3C(=O)N(C(=O)N4C)C

InChI

InChI=1S/C17H16N6O3/c1-10-5-4-6-12-19-11(7-13(24)23(10)12)8-22-9-18-15-14(22)16(25)21(3)17(26)20(15)2/h4-7,9H,8H2,1-3H3