3-methyl-8-morpholin-4-yl-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 3-methyl-8-morpholin-4-yl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-3-methyl-8-morpholino-purine-2,6-dione CAS Name: 3-methyl-8-(4-morpholinyl)-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-3-methyl-8-morpholin-4-ylpurine-2,6-dione Traditional Name: 7-benzyl-3-methyl-8-morpholino-xanthine Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C17H19N5O3/c1-20-14-13(15(23)19-17(20)24)22(11-12-5-3-2-4-6-12)16(18-14)21-7-9-25-10-8-21/h2-6H,7-11H2,1H3,(H,19,23,24)