4-tert-butyl-3-[6-(3-ethoxyphenoxy)-8,9-diethyl-purin-2-yl]oxy-benzenecarboximidamide

Systemtic Name: 4-tert-butyl-3-[6-(3-ethoxyphenoxy)-8,9-diethyl-purin-2-yl]oxy-benzenecarboximidamide Openeye Name: 4-tert-butyl-3-[6-(3-ethoxyphenoxy)-8,9-diethyl-purin-2-yl]oxy-benzamidine CAS Name: 4-tert-butyl-3-[[6-(3-ethoxyphenoxy)-8,9-diethyl-2-purinyl]oxy]benzenecarboximidamide IUPAC Name: 4-tert-butyl-3-[6-(3-ethoxyphenoxy)-8,9-diethylpurin-2-yl]oxybenzenecarboximidamide Traditional Name: 4-tert-butyl-3-[6-(3-ethoxyphenoxy)-8,9-diethyl-purin-2-yl]oxy-benzamidine Formula: C28H34N6O3 MolecularWeight: 502.60796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC)N=C(N=C2OC3=CC(=CC=C3)OCC)OC4=C(C=CC(=C4)C(=N)N)C(C)(C)C

Isomeric SMILES

CCC1=NC2=C(N1CC)N=C(N=C2OC3=CC(=CC=C3)OCC)OC4=C(C=CC(=C4)C(=N)N)C(C)(C)C

InChI

InChI=1S/C28H34N6O3/c1-7-22-31-23-25(34(22)8-2)32-27(33-26(23)36-19-12-10-11-18(16-19)35-9-3)37-21-15-17(24(29)30)13-14-20(21)28(4,5)6/h10-16H,7-9H2,1-6H3,(H3,29,30)