8-(furan-2-ylmethylamino)-7-(2-methoxyethyl)-3-methyl-purine-2,6-dione

Systemtic Name: 8-(furan-2-ylmethylamino)-7-(2-methoxyethyl)-3-methyl-purine-2,6-dione Openeye Name: 8-(2-furylmethylamino)-7-(2-methoxyethyl)-3-methyl-purine-2,6-dione CAS Name: 8-(2-furanylmethylamino)-7-(2-methoxyethyl)-3-methylpurine-2,6-dione IUPAC Name: 8-(furan-2-ylmethylamino)-7-(2-methoxyethyl)-3-methylpurine-2,6-dione Traditional Name: 8-(2-furfurylamino)-7-(2-methoxyethyl)-3-methyl-xanthine Formula: C14H17N5O4 MolecularWeight: 319.31588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCC3=CC=CO3)CCOC

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCC3=CC=CO3)CCOC

InChI

InChI=1S/C14H17N5O4/c1-18-11-10(12(20)17-14(18)21)19(5-7-22-2)13(16-11)15-8-9-4-3-6-23-9/h3-4,6H,5,7-8H2,1-2H3,(H,15,16)(H,17,20,21)