8-(1-propan-2-ylsulfonylpiperidin-4-yl)-7H-purine-2,6-diamine dihydrochloride

Systemtic Name: 8-(1-propan-2-ylsulfonylpiperidin-4-yl)-7H-purine-2,6-diamine dihydrochloride Openeye Name: 8-(1-isopropylsulfonyl-4-piperidyl)-7H-purine-2,6-diamine dihydrochloride CAS Name: 8-(1-propan-2-ylsulfonyl-4-piperidinyl)-7H-purine-2,6-diamine dihydrochloride IUPAC Name: 8-(1-propan-2-ylsulfonylpiperidin-4-yl)-7H-purine-2,6-diamine dihydrochloride Traditional Name: [2-amino-8-(1-isopropylsulfonyl-4-piperidyl)-7H-purin-6-yl]amine dihydrochloride Formula: C13H23Cl2N7O2S MolecularWeight: 412.33842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCC(CC1)C2=NC3=C(N2)C(=NC(=N3)N)N.Cl.Cl

Isomeric SMILES

CC(C)S(=O)(=O)N1CCC(CC1)C2=NC3=C(N2)C(=NC(=N3)N)N.Cl.Cl

InChI

InChI=1S/C13H21N7O2S.2ClH/c1-7(2)23(21,22)20-5-3-8(4-6-20)11-16-9-10(14)17-13(15)19-12(9)18-11;;/h7-8H,3-6H2,1-2H3,(H5,14,15,16,17,18,19);2*1H