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

Systemtic Name: 3-methyl-7-[[5-(piperidin-1-ylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione Openeye Name: 3-methyl-7-[[5-(1-piperidylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione CAS Name: 3-methyl-7-[[5-(1-piperidinylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione IUPAC Name: 3-methyl-7-[[5-(piperidin-1-ylmethyl)-1,2,4-oxadiazol-3-yl]methyl]purine-2,6-dione Traditional Name: 3-methyl-7-[[5-(piperidinomethyl)-1,2,4-oxadiazol-3-yl]methyl]xanthine Formula: C15H19N7O3 MolecularWeight: 345.35646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3=NOC(=N3)CN4CCCCC4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CC3=NOC(=N3)CN4CCCCC4

InChI

InChI=1S/C15H19N7O3/c1-20-13-12(14(23)18-15(20)24)22(9-16-13)7-10-17-11(25-19-10)8-21-5-3-2-4-6-21/h9H,2-8H2,1H3,(H,18,23,24)