8-[(2,6-dimethylmorpholin-4-yl)methyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-[(2,6-dimethylmorpholin-4-yl)methyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-8-[(2,6-dimethylmorpholin-4-yl)methyl]-3-methyl-purine-2,6-dione CAS Name: 8-[(2,6-dimethyl-4-morpholinyl)methyl]-3-methyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-[(2,6-dimethylmorpholin-4-yl)methyl]-3-methylpurine-2,6-dione Traditional Name: 7-benzyl-8-[(2,6-dimethylmorpholino)methyl]-3-methyl-xanthine Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CC2=NC3=C(N2CC4=CC=CC=C4)C(=O)NC(=O)N3C

Isomeric SMILES

CC1CN(CC(O1)C)CC2=NC3=C(N2CC4=CC=CC=C4)C(=O)NC(=O)N3C

InChI

InChI=1S/C20H25N5O3/c1-13-9-24(10-14(2)28-13)12-16-21-18-17(19(26)22-20(27)23(18)3)25(16)11-15-7-5-4-6-8-15/h4-8,13-14H,9-12H2,1-3H3,(H,22,26,27)