N-ethyl-3-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)purin-6-amine hydrochloride

Systemtic Name: N-ethyl-3-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)purin-6-amine hydrochloride Openeye Name: 3-[(3-benzyloxy-4-methoxy-phenyl)methyl]-8-(1-benzyloxy-1-methyl-ethyl)-N-ethyl-purin-6-amine hydrochloride CAS Name: N-ethyl-3-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)-6-purinamine hydrochloride IUPAC Name: N-ethyl-3-[(4-methoxy-3-phenylmethoxyphenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)purin-6-amine hydrochloride Traditional Name: [3-(3-benzoxy-4-methoxy-benzyl)-8-(1-benzoxy-1-methyl-ethyl)purin-6-yl]-ethyl-amine hydrochloride Formula: C32H36ClN5O3 MolecularWeight: 574.11294

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C2C(=NC(=N2)C(C)(C)OCC3=CC=CC=C3)N(C=N1)CC4=CC(=C(C=C4)OC)OCC5=CC=CC=C5.Cl

Isomeric SMILES

CCNC1=C2C(=NC(=N2)C(C)(C)OCC3=CC=CC=C3)N(C=N1)CC4=CC(=C(C=C4)OC)OCC5=CC=CC=C5.Cl

InChI

InChI=1S/C32H35N5O3.ClH/c1-5-33-29-28-30(36-31(35-28)32(2,3)40-21-24-14-10-7-11-15-24)37(22-34-29)19-25-16-17-26(38-4)27(18-25)39-20-23-12-8-6-9-13-23;/h6-18,22,33H,5,19-21H2,1-4H3;1H