7-(2-chloranylpropyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-(2-chloranylpropyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(2-chloropropyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(2-chloropropyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(2-chloropropyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(2-chloropropyl)-1,3-dimethyl-xanthine Formula: C10H13ClN4O2 MolecularWeight: 256.68882

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)Cl

Isomeric SMILES

CC(CN1C=NC2=C1C(=O)N(C(=O)N2C)C)Cl

InChI

InChI=1S/C10H13ClN4O2/c1-6(11)4-15-5-12-8-7(15)9(16)14(3)10(17)13(8)2/h5-6H,4H2,1-3H3