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

Systemtic Name: 7-[4-(3,5-dimethyl-1,2-oxazol-4-yl)butyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[4-(3,5-dimethylisoxazol-4-yl)butyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[4-(3,5-dimethyl-4-isoxazolyl)butyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[4-(3,5-dimethyl-1,2-oxazol-4-yl)butyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[4-(3,5-dimethylisoxazol-4-yl)butyl]-1,3-dimethyl-xanthine Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCCCN2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=C(C(=NO1)C)CCCCN2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C16H21N5O3/c1-10-12(11(2)24-18-10)7-5-6-8-21-9-17-14-13(21)15(22)20(4)16(23)19(14)3/h9H,5-8H2,1-4H3