7-[2-(furan-2-ylmethylamino)ethyl]-3-methyl-purine-2,6-dione

Systemtic Name: 7-[2-(furan-2-ylmethylamino)ethyl]-3-methyl-purine-2,6-dione Openeye Name: 7-[2-(2-furylmethylamino)ethyl]-3-methyl-purine-2,6-dione CAS Name: 7-[2-(2-furanylmethylamino)ethyl]-3-methylpurine-2,6-dione IUPAC Name: 7-[2-(furan-2-ylmethylamino)ethyl]-3-methylpurine-2,6-dione Traditional Name: 7-[2-(2-furfurylamino)ethyl]-3-methyl-xanthine Formula: C13H15N5O3 MolecularWeight: 289.2899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CCNCC3=CC=CO3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CCNCC3=CC=CO3

InChI

InChI=1S/C13H15N5O3/c1-17-11-10(12(19)16-13(17)20)18(8-15-11)5-4-14-7-9-3-2-6-21-9/h2-3,6,8,14H,4-5,7H2,1H3,(H,16,19,20)