3-methyl-7-[[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione

Systemtic Name: 3-methyl-7-[[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione Openeye Name: 3-methyl-7-[[5-(morpholinomethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione CAS Name: 3-methyl-7-[[5-(4-morpholinylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione IUPAC Name: 3-methyl-7-[[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione Traditional Name: 3-methyl-7-[[5-(morpholinomethyl)-1,2,4-oxadiazol-3-yl]methyl]xanthine Formula: C14H17N7O4 MolecularWeight: 347.32928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3=NOC(=N3)CN4CCOCC4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3=NOC(=N3)CN4CCOCC4

InChI

InChI=1S/C14H17N7O4/c1-19-12-11(13(22)17-14(19)23)21(8-15-12)6-9-16-10(25-18-9)7-20-2-4-24-5-3-20/h8H,2-7H2,1H3,(H,17,22,23)