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

Systemtic Name: 7-decyl-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]purine-2,6-dione Openeye Name: 7-decyl-1,3-dimethyl-8-[(2-methyl-1-piperidyl)methyl]purine-2,6-dione CAS Name: 7-decyl-1,3-dimethyl-8-[(2-methyl-1-piperidinyl)methyl]purine-2,6-dione IUPAC Name: 7-decyl-1,3-dimethyl-8-[(2-methylpiperidin-1-yl)methyl]purine-2,6-dione Traditional Name: 7-decyl-1,3-dimethyl-8-[(2-methylpiperidino)methyl]xanthine Formula: C24H41N5O2 MolecularWeight: 431.61464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCCCC3C

Isomeric SMILES

CCCCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCCCC3C

InChI

InChI=1S/C24H41N5O2/c1-5-6-7-8-9-10-11-13-17-29-20(18-28-16-14-12-15-19(28)2)25-22-21(29)23(30)27(4)24(31)26(22)3/h19H,5-18H2,1-4H3