7-[[3-(diethylamino)-5-propyl-2H-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[[3-(diethylamino)-5-propyl-2H-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[[3-(diethylamino)-5-propyl-2H-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[[3-(diethylamino)-5-propyl-2H-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[[3-(diethylamino)-5-propyl-2H-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[[3-(diethylamino)-5-propyl-2H-1,2,4-oxadiazol-3-yl]methyl]-1,3-dimethyl-xanthine Formula: C17H27N7O3 MolecularWeight: 377.44138

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(NO1)(CN2C=NC3=C2C(=O)N(C(=O)N3C)C)N(CC)CC

Isomeric SMILES

CCCC1=NC(NO1)(CN2C=NC3=C2C(=O)N(C(=O)N3C)C)N(CC)CC

InChI

InChI=1S/C17H27N7O3/c1-6-9-12-19-17(20-27-12,24(7-2)8-3)10-23-11-18-14-13(23)15(25)22(5)16(26)21(14)4/h11,20H,6-10H2,1-5H3