8-cyclohexyl-7-methyl-1,3-dipropyl-purine-2,6-dione

Systemtic Name: 8-cyclohexyl-7-methyl-1,3-dipropyl-purine-2,6-dione Openeye Name: 8-cyclohexyl-7-methyl-1,3-dipropyl-purine-2,6-dione CAS Name: 8-cyclohexyl-7-methyl-1,3-dipropylpurine-2,6-dione IUPAC Name: 8-cyclohexyl-7-methyl-1,3-dipropylpurine-2,6-dione Traditional Name: 8-cyclohexyl-7-methyl-1,3-dipropyl-xanthine Formula: C18H28N4O2 MolecularWeight: 332.44052

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)N(C(=N2)C3CCCCC3)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)N(C(=N2)C3CCCCC3)C

InChI

InChI=1S/C18H28N4O2/c1-4-11-21-16-14(17(23)22(12-5-2)18(21)24)20(3)15(19-16)13-9-7-6-8-10-13/h13H,4-12H2,1-3H3