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1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-[(4-methylpiperidin-1-yl)methyl]purine-2,6-dione

1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-[(4-methylpiperidin-1-yl)methyl]purine-2,6-dione

Systemtic Name:1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-[(4-methylpiperidin-1-yl)methyl]purine-2,6-dione
Openeye Name:1,3-dimethyl-8-[(4-methyl-1-piperidyl)methyl]-7-(p-tolylmethyl)purine-2,6-dione
CAS Name:1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-[(4-methyl-1-piperidinyl)methyl]purine-2,6-dione
IUPAC Name:1,3-dimethyl-7-[(4-methylphenyl)methyl]-8-[(4-methylpiperidin-1-yl)methyl]purine-2,6-dione
Traditional Name:1,3-dimethyl-7-(4-methylbenzyl)-8-[(4-methylpiperidino)methyl]xanthine
Formula: C22H29N5O2
MolecularWeight: 395.49796
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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=NC3=C(N2CC4=CC=C(C=C4)C)C(=O)N(C(=O)N3C)C


Isomeric SMILES

CC1CCN(CC1)CC2=NC3=C(N2CC4=CC=C(C=C4)C)C(=O)N(C(=O)N3C)C


InChI

InChI=1S/C22H29N5O2/c1-15-5-7-17(8-6-15)13-27-18(14-26-11-9-16(2)10-12-26)23-20-19(27)21(28)25(4)22(29)24(20)3/h5-8,16H,9-14H2,1-4H3


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