8-(furan-2-ylmethylamino)-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-(furan-2-ylmethylamino)-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-(2-furylmethylamino)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(2-furanylmethylamino)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-(furan-2-ylmethylamino)-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(2-furfurylamino)-1,3,7-trimethyl-xanthine Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NCC3=CC=CO3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1NCC3=CC=CO3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C13H15N5O3/c1-16-9-10(17(2)13(20)18(3)11(9)19)15-12(16)14-7-8-5-4-6-21-8/h4-6H,7H2,1-3H3,(H,14,15)