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

Systemtic Name: 7-ethyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-3-(phenylmethyl)purine-2,6-dione Openeye Name: 3-benzyl-7-ethyl-1-(2-morpholino-2-oxo-ethyl)purine-2,6-dione CAS Name: 7-ethyl-1-[2-(4-morpholinyl)-2-oxoethyl]-3-(phenylmethyl)purine-2,6-dione IUPAC Name: 3-benzyl-7-ethyl-1-(2-morpholin-4-yl-2-oxoethyl)purine-2,6-dione Traditional Name: 3-benzyl-7-ethyl-1-(2-keto-2-morpholino-ethyl)xanthine Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)N4CCOCC4

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)N4CCOCC4

InChI

InChI=1S/C20H23N5O4/c1-2-22-14-21-18-17(22)19(27)25(13-16(26)23-8-10-29-11-9-23)20(28)24(18)12-15-6-4-3-5-7-15/h3-7,14H,2,8-13H2,1H3