8-(butylamino)-1,3,7-triethyl-purine-2,6-dione

Systemtic Name: 8-(butylamino)-1,3,7-triethyl-purine-2,6-dione Openeye Name: 8-(butylamino)-1,3,7-triethyl-purine-2,6-dione CAS Name: 8-(butylamino)-1,3,7-triethylpurine-2,6-dione IUPAC Name: 8-(butylamino)-1,3,7-triethylpurine-2,6-dione Traditional Name: 8-(butylamino)-1,3,7-triethyl-xanthine Formula: C15H25N5O2 MolecularWeight: 307.3913

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(N1CC)C(=O)N(C(=O)N2CC)CC

Isomeric SMILES

CCCCNC1=NC2=C(N1CC)C(=O)N(C(=O)N2CC)CC

InChI

InChI=1S/C15H25N5O2/c1-5-9-10-16-14-17-12-11(18(14)6-2)13(21)20(8-4)15(22)19(12)7-3/h5-10H2,1-4H3,(H,16,17)