8-(dimethylamino)-7-dodecyl-3-methyl-purine-2,6-dione

Systemtic Name: 8-(dimethylamino)-7-dodecyl-3-methyl-purine-2,6-dione Openeye Name: 8-(dimethylamino)-7-dodecyl-3-methyl-purine-2,6-dione CAS Name: 8-(dimethylamino)-7-dodecyl-3-methylpurine-2,6-dione IUPAC Name: 8-(dimethylamino)-7-dodecyl-3-methylpurine-2,6-dione Traditional Name: 8-(dimethylamino)-7-lauryl-3-methyl-xanthine Formula: C20H35N5O2 MolecularWeight: 377.5242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C2=C(N=C1N(C)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCN1C2=C(N=C1N(C)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C20H35N5O2/c1-5-6-7-8-9-10-11-12-13-14-15-25-16-17(21-19(25)23(2)3)24(4)20(27)22-18(16)26/h5-15H2,1-4H3,(H,22,26,27)