3-methyl-7-(3-methylbut-2-enyl)-1-(2-oxidanylideneoxolan-3-yl)-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name: 3-methyl-7-(3-methylbut-2-enyl)-1-(2-oxidanylideneoxolan-3-yl)-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 3-methyl-7-(3-methylbut-2-enyl)-1-(2-oxotetrahydrofuran-3-yl)-8-piperazin-1-yl-purine-2,6-dione CAS Name: 3-methyl-7-(3-methylbut-2-enyl)-1-(2-oxo-3-oxolanyl)-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 3-methyl-7-(3-methylbut-2-enyl)-1-(2-oxooxolan-3-yl)-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 1-(2-ketotetrahydrofuran-3-yl)-3-methyl-7-(3-methylbut-2-enyl)-8-piperazino-xanthine Formula: C19H26N6O4 MolecularWeight: 402.44754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C4CCOC4=O)C)C

Isomeric SMILES

CC(=CCN1C2=C(N=C1N3CCNCC3)N(C(=O)N(C2=O)C4CCOC4=O)C)C

InChI

InChI=1S/C19H26N6O4/c1-12(2)4-8-24-14-15(21-18(24)23-9-6-20-7-10-23)22(3)19(28)25(16(14)26)13-5-11-29-17(13)27/h4,13,20H,5-11H2,1-3H3