7-but-3-enyl-1,3-dibutyl-purine-2,6-dione

Systemtic Name: 7-but-3-enyl-1,3-dibutyl-purine-2,6-dione Openeye Name: 7-but-3-enyl-1,3-dibutyl-purine-2,6-dione CAS Name: 7-but-3-enyl-1,3-dibutylpurine-2,6-dione IUPAC Name: 7-but-3-enyl-1,3-dibutylpurine-2,6-dione Traditional Name: 7-but-3-enyl-1,3-dibutyl-xanthine Formula: C17H26N4O2 MolecularWeight: 318.41394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)CCC=C

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)CCC=C

InChI

InChI=1S/C17H26N4O2/c1-4-7-10-19-13-18-15-14(19)16(22)21(12-9-6-3)17(23)20(15)11-8-5-2/h4,13H,1,5-12H2,2-3H3