7-(furan-2-ylmethyl)-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-(phenylmethyl)purine-2,6-dione

Systemtic Name: 7-(furan-2-ylmethyl)-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-(phenylmethyl)purine-2,6-dione Openeye Name: 3-benzyl-7-(2-furylmethyl)-1-(2-morpholino-2-oxo-ethyl)purine-2,6-dione CAS Name: 7-(2-furanylmethyl)-1-[2-(4-morpholinyl)-2-oxoethyl]-3-(phenylmethyl)purine-2,6-dione IUPAC Name: 3-benzyl-7-(furan-2-ylmethyl)-1-(2-morpholin-4-yl-2-oxoethyl)purine-2,6-dione Traditional Name: 3-benzyl-7-(2-furfuryl)-1-(2-keto-2-morpholino-ethyl)xanthine Formula: C23H23N5O5 MolecularWeight: 449.45922

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CN2C(=O)C3=C(N=CN3CC4=CC=CO4)N(C2=O)CC5=CC=CC=C5

Isomeric SMILES

C1COCCN1C(=O)CN2C(=O)C3=C(N=CN3CC4=CC=CO4)N(C2=O)CC5=CC=CC=C5

InChI

InChI=1S/C23H23N5O5/c29-19(25-8-11-32-12-9-25)15-28-22(30)20-21(24-16-26(20)14-18-7-4-10-33-18)27(23(28)31)13-17-5-2-1-3-6-17/h1-7,10,16H,8-9,11-15H2