7-[2-(2-chloranylpropylamino)ethyl]-1,3-dimethyl-purine-2,6-dione hydrochloride

Systemtic Name: 7-[2-(2-chloranylpropylamino)ethyl]-1,3-dimethyl-purine-2,6-dione hydrochloride Openeye Name: 7-[2-(2-chloropropylamino)ethyl]-1,3-dimethyl-purine-2,6-dione hydrochloride CAS Name: 7-[2-(2-chloropropylamino)ethyl]-1,3-dimethylpurine-2,6-dione hydrochloride IUPAC Name: 7-[2-(2-chloropropylamino)ethyl]-1,3-dimethylpurine-2,6-dione hydrochloride Traditional Name: 7-[2-(2-chloropropylamino)ethyl]-1,3-dimethyl-xanthine hydrochloride Formula: C12H19Cl2N5O2 MolecularWeight: 336.21756

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)Cl.Cl

Isomeric SMILES

CC(CNCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)Cl.Cl

InChI

InChI=1S/C12H18ClN5O2.ClH/c1-8(13)6-14-4-5-18-7-15-10-9(18)11(19)17(3)12(20)16(10)2;/h7-8,14H,4-6H2,1-3H3;1H