9-cyclopentyl-N-ethyl-3-(5-methoxyindol-1-yl)-2H-purin-2-amine dihydrochloride

Systemtic Name: 9-cyclopentyl-N-ethyl-3-(5-methoxyindol-1-yl)-2H-purin-2-amine dihydrochloride Openeye Name: 9-cyclopentyl-N-ethyl-3-(5-methoxyindol-1-yl)-2H-purin-2-amine dihydrochloride CAS Name: 9-cyclopentyl-N-ethyl-3-(5-methoxy-1-indolyl)-2H-purin-2-amine dihydrochloride IUPAC Name: 9-cyclopentyl-N-ethyl-3-(5-methoxyindol-1-yl)-2H-purin-2-amine dihydrochloride Traditional Name: [9-cyclopentyl-3-(5-methoxyindol-1-yl)-2H-purin-2-yl]-ethyl-amine dihydrochloride Formula: C21H28Cl2N6O MolecularWeight: 451.39262

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1N=CC2=C(N1N3C=CC4=C3C=CC(=C4)OC)N(C=N2)C5CCCC5.Cl.Cl

Isomeric SMILES

CCNC1N=CC2=C(N1N3C=CC4=C3C=CC(=C4)OC)N(C=N2)C5CCCC5.Cl.Cl

InChI

InChI=1S/C21H26N6O.2ClH/c1-3-22-21-23-13-18-20(25(14-24-18)16-6-4-5-7-16)27(21)26-11-10-15-12-17(28-2)8-9-19(15)26;;/h8-14,16,21-22H,3-7H2,1-2H3;2*1H