1,3-dimethyl-7-[3-[methyl(2,3,4,5-tetrahydropyridin-6-yl)amino]-2-oxidanyl-propyl]purine-2,6-dione hydrochloride

Systemtic Name: 1,3-dimethyl-7-[3-[methyl(2,3,4,5-tetrahydropyridin-6-yl)amino]-2-oxidanyl-propyl]purine-2,6-dione hydrochloride Openeye Name: 7-[2-hydroxy-3-[methyl(2,3,4,5-tetrahydropyridin-6-yl)amino]propyl]-1,3-dimethyl-purine-2,6-dione hydrochloride CAS Name: 7-[2-hydroxy-3-[methyl(2,3,4,5-tetrahydropyridin-6-yl)amino]propyl]-1,3-dimethylpurine-2,6-dione hydrochloride IUPAC Name: 7-[2-hydroxy-3-[methyl(2,3,4,5-tetrahydropyridin-6-yl)amino]propyl]-1,3-dimethylpurine-2,6-dione hydrochloride Traditional Name: 7-[2-hydroxy-3-[methyl(2,3,4,5-tetrahydropyridin-6-yl)amino]propyl]-1,3-dimethyl-xanthine hydrochloride Formula: C16H25ClN6O3 MolecularWeight: 384.8611

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN(C)C3=NCCCC3)O.Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(CN(C)C3=NCCCC3)O.Cl

InChI

InChI=1S/C16H24N6O3.ClH/c1-19(12-6-4-5-7-17-12)8-11(23)9-22-10-18-14-13(22)15(24)21(3)16(25)20(14)2;/h10-11,23H,4-9H2,1-3H3;1H