7-dodecyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione

Systemtic Name: 7-dodecyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione Openeye Name: 7-dodecyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione CAS Name: 7-dodecyl-3-methyl-8-(4-methyl-1-piperazinyl)purine-2,6-dione IUPAC Name: 7-dodecyl-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione Traditional Name: 7-lauryl-3-methyl-8-(4-methylpiperazino)xanthine Formula: C23H40N6O2 MolecularWeight: 432.6027

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C2=C(N=C1N3CCN(CC3)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCN1C2=C(N=C1N3CCN(CC3)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C23H40N6O2/c1-4-5-6-7-8-9-10-11-12-13-14-29-19-20(27(3)23(31)25-21(19)30)24-22(29)28-17-15-26(2)16-18-28/h4-18H2,1-3H3,(H,25,30,31)