8-(furan-2-ylmethylamino)-3-methyl-7-[(2R)-2-oxidanylpropyl]purine-2,6-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(N=C1NCC3=CC=CO3)N(C(=O)NC2=O)C)O

Isomeric SMILES

C[C@H](CN1C2=C(N=C1NCC3=CC=CO3)N(C(=O)NC2=O)C)O

InChI

InChI=1S/C14H17N5O4/c1-8(20)7-19-10-11(18(2)14(22)17-12(10)21)16-13(19)15-6-9-4-3-5-23-9/h3-5,8,20H,6-7H2,1-2H3,(H,15,16)(H,17,21,22)/t8-/m1/s1