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

Systemtic Name: 7-[[5-(diethylaminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methyl-purine-2,6-dione Openeye Name: 7-[[5-(diethylaminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methyl-purine-2,6-dione CAS Name: 7-[[5-(diethylaminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methylpurine-2,6-dione IUPAC Name: 7-[[5-(diethylaminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methylpurine-2,6-dione Traditional Name: 7-[[5-(diethylaminomethyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methyl-xanthine Formula: C14H19N7O3 MolecularWeight: 333.34576

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC(=NO1)CN2C=NC3=C2C(=O)NC(=O)N3C

Isomeric SMILES

CCN(CC)CC1=NC(=NO1)CN2C=NC3=C2C(=O)NC(=O)N3C

InChI

InChI=1S/C14H19N7O3/c1-4-20(5-2)7-10-16-9(18-24-10)6-21-8-15-12-11(21)13(22)17-14(23)19(12)3/h8H,4-7H2,1-3H3,(H,17,22,23)