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

Systemtic Name: 8-(1-thiophen-2-ylsulfonylpiperidin-4-yl)-7H-purine-2,6-diamine dihydrochloride Openeye Name: 8-[1-(2-thienylsulfonyl)-4-piperidyl]-7H-purine-2,6-diamine dihydrochloride CAS Name: 8-(1-thiophen-2-ylsulfonyl-4-piperidinyl)-7H-purine-2,6-diamine dihydrochloride IUPAC Name: 8-(1-thiophen-2-ylsulfonylpiperidin-4-yl)-7H-purine-2,6-diamine dihydrochloride Traditional Name: [2-amino-8-[1-(2-thienylsulfonyl)-4-piperidyl]-7H-purin-6-yl]amine dihydrochloride Formula: C14H19Cl2N7O2S2 MolecularWeight: 452.38236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(N2)C(=NC(=N3)N)N)S(=O)(=O)C4=CC=CS4.Cl.Cl

Isomeric SMILES

C1CN(CCC1C2=NC3=C(N2)C(=NC(=N3)N)N)S(=O)(=O)C4=CC=CS4.Cl.Cl

InChI

InChI=1S/C14H17N7O2S2.2ClH/c15-11-10-13(20-14(16)18-11)19-12(17-10)8-3-5-21(6-4-8)25(22,23)9-2-1-7-24-9;;/h1-2,7-8H,3-6H2,(H5,15,16,17,18,19,20);2*1H