7-[(5-methoxy-4,6-dimethyl-pyridin-2-yl)methyl]-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name: 7-[(5-methoxy-4,6-dimethyl-pyridin-2-yl)methyl]-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 7-[(5-methoxy-4,6-dimethyl-2-pyridyl)methyl]-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione CAS Name: 7-[(5-methoxy-4,6-dimethyl-2-pyridinyl)methyl]-1,3-dimethyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-[(5-methoxy-4,6-dimethylpyridin-2-yl)methyl]-1,3-dimethyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 7-[(5-methoxy-4,6-dimethyl-2-pyridyl)methyl]-1,3-dimethyl-8-piperazino-xanthine Formula: C20H27N7O3 MolecularWeight: 413.47348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1OC)C)CN2C3=C(N=C2N4CCNCC4)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CC(=NC(=C1OC)C)CN2C3=C(N=C2N4CCNCC4)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C20H27N7O3/c1-12-10-14(22-13(2)16(12)30-5)11-27-15-17(24(3)20(29)25(4)18(15)28)23-19(27)26-8-6-21-7-9-26/h10,21H,6-9,11H2,1-5H3