1,3-dibutyl-7-[(3,5-dimethyl-1,2-oxazol-4-yl)oxy]purine-2,6-dione

Systemtic Name: 1,3-dibutyl-7-[(3,5-dimethyl-1,2-oxazol-4-yl)oxy]purine-2,6-dione Openeye Name: 1,3-dibutyl-7-(3,5-dimethylisoxazol-4-yl)oxy-purine-2,6-dione CAS Name: 1,3-dibutyl-7-[(3,5-dimethyl-4-isoxazolyl)oxy]purine-2,6-dione IUPAC Name: 1,3-dibutyl-7-[(3,5-dimethyl-1,2-oxazol-4-yl)oxy]purine-2,6-dione Traditional Name: 1,3-dibutyl-7-(3,5-dimethylisoxazol-4-yl)oxy-xanthine Formula: C18H25N5O4 MolecularWeight: 375.4222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)OC3=C(ON=C3C)C

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)OC3=C(ON=C3C)C

InChI

InChI=1S/C18H25N5O4/c1-5-7-9-21-16-14(17(24)22(18(21)25)10-8-6-2)23(11-19-16)27-15-12(3)20-26-13(15)4/h11H,5-10H2,1-4H3