3-methyl-1-(5-methylhex-4-enyl)-7-propyl-purine-2,6-dione

Systemtic Name: 3-methyl-1-(5-methylhex-4-enyl)-7-propyl-purine-2,6-dione Openeye Name: 3-methyl-1-(5-methylhex-4-enyl)-7-propyl-purine-2,6-dione CAS Name: 3-methyl-1-(5-methylhex-4-enyl)-7-propylpurine-2,6-dione IUPAC Name: 3-methyl-1-(5-methylhex-4-enyl)-7-propylpurine-2,6-dione Traditional Name: 3-methyl-1-(5-methylhex-4-enyl)-7-propyl-xanthine Formula: C16H24N4O2 MolecularWeight: 304.38736

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCC=C(C)C

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCC=C(C)C

InChI

InChI=1S/C16H24N4O2/c1-5-9-19-11-17-14-13(19)15(21)20(16(22)18(14)4)10-7-6-8-12(2)3/h8,11H,5-7,9-10H2,1-4H3