8-(butylamino)-1,3-dimethyl-7-propyl-purine-2,6-dione

Systemtic Name: 8-(butylamino)-1,3-dimethyl-7-propyl-purine-2,6-dione Openeye Name: 8-(butylamino)-1,3-dimethyl-7-propyl-purine-2,6-dione CAS Name: 8-(butylamino)-1,3-dimethyl-7-propylpurine-2,6-dione IUPAC Name: 8-(butylamino)-1,3-dimethyl-7-propylpurine-2,6-dione Traditional Name: 8-(butylamino)-1,3-dimethyl-7-propyl-xanthine Formula: C14H23N5O2 MolecularWeight: 293.36472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(N1CCC)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCCNC1=NC2=C(N1CCC)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C14H23N5O2/c1-5-7-8-15-13-16-11-10(19(13)9-6-2)12(20)18(4)14(21)17(11)3/h5-9H2,1-4H3,(H,15,16)