N-cyclopentyl-2-[[6-(cyclopentylamino)-8-cyclopropyl-3-propyl-purin-2-yl]sulfanylmethylsulfanyl]-8-cyclopropyl-3-propyl-purin-6-amine dihydrochloride

Systemtic Name: N-cyclopentyl-2-[[6-(cyclopentylamino)-8-cyclopropyl-3-propyl-purin-2-yl]sulfanylmethylsulfanyl]-8-cyclopropyl-3-propyl-purin-6-amine dihydrochloride Openeye Name: N-cyclopentyl-2-[[6-(cyclopentylamino)-8-cyclopropyl-3-propyl-purin-2-yl]sulfanylmethylsulfanyl]-8-cyclopropyl-3-propyl-purin-6-amine dihydrochloride CAS Name: N-cyclopentyl-2-[[[6-(cyclopentylamino)-8-cyclopropyl-3-propyl-2-purinyl]thio]methylthio]-8-cyclopropyl-3-propyl-6-purinamine dihydrochloride IUPAC Name: N-cyclopentyl-2-[[6-(cyclopentylamino)-8-cyclopropyl-3-propylpurin-2-yl]sulfanylmethylsulfanyl]-8-cyclopropyl-3-propylpurin-6-amine dihydrochloride Traditional Name: cyclopentyl-[2-[[[6-(cyclopentylamino)-8-cyclopropyl-3-propyl-purin-2-yl]thio]methylthio]-8-cyclopropyl-3-propyl-purin-6-yl]amine dihydrochloride Formula: C33H48Cl2N10S2 MolecularWeight: 719.83722

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC(=NC2=C(N=C1SCSC3=NC(=C4C(=NC(=N4)C5CC5)N3CCC)NC6CCCC6)NC7CCCC7)C8CC8.Cl.Cl

Isomeric SMILES

CCCN1C2=NC(=NC2=C(N=C1SCSC3=NC(=C4C(=NC(=N4)C5CC5)N3CCC)NC6CCCC6)NC7CCCC7)C8CC8.Cl.Cl

InChI

InChI=1S/C33H46N10S2.2ClH/c1-3-17-42-30-24(36-26(38-30)20-13-14-20)28(34-22-9-5-6-10-22)40-32(42)44-19-45-33-41-29(35-23-11-7-8-12-23)25-31(43(33)18-4-2)39-27(37-25)21-15-16-21;;/h20-23,34-35H,3-19H2,1-2H3;2*1H