3-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]propan-1-ol dihydrochloride

Systemtic Name: 3-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]propan-1-ol dihydrochloride Openeye Name: 3-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]propan-1-ol dihydrochloride CAS Name: 3-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]-1-propanol dihydrochloride IUPAC Name: 3-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]propan-1-ol dihydrochloride Traditional Name: 3-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]propan-1-ol dihydrochloride Formula: C19H33Cl2N7O MolecularWeight: 446.41762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCCO)NC4CCC(CC4)N.Cl.Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCCO)NC4CCC(CC4)N.Cl.Cl

InChI

InChI=1S/C19H31N7O.2ClH/c20-13-6-8-14(9-7-13)23-19-24-17(21-10-3-11-27)16-18(25-19)26(12-22-16)15-4-1-2-5-15;;/h12-15,27H,1-11,20H2,(H2,21,23,24,25);2*1H