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

Systemtic Name: 4-tert-butyl-3-[6-(3-ethoxyphenoxy)-8-methyl-9-(phenylmethyl)purin-2-yl]oxy-benzenecarboximidamide Openeye Name: 3-[9-benzyl-6-(3-ethoxyphenoxy)-8-methyl-purin-2-yl]oxy-4-tert-butyl-benzamidine CAS Name: 4-tert-butyl-3-[[6-(3-ethoxyphenoxy)-8-methyl-9-(phenylmethyl)-2-purinyl]oxy]benzenecarboximidamide IUPAC Name: 3-[9-benzyl-6-(3-ethoxyphenoxy)-8-methylpurin-2-yl]oxy-4-tert-butylbenzenecarboximidamide Traditional Name: 3-[9-benzyl-6-(3-ethoxyphenoxy)-8-methyl-purin-2-yl]oxy-4-tert-butyl-benzamidine Formula: C32H34N6O3 MolecularWeight: 550.65076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)OC2=NC(=NC3=C2N=C(N3CC4=CC=CC=C4)C)OC5=C(C=CC(=C5)C(=N)N)C(C)(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)OC2=NC(=NC3=C2N=C(N3CC4=CC=CC=C4)C)OC5=C(C=CC(=C5)C(=N)N)C(C)(C)C

InChI

InChI=1S/C32H34N6O3/c1-6-39-23-13-10-14-24(18-23)40-30-27-29(38(20(2)35-27)19-21-11-8-7-9-12-21)36-31(37-30)41-26-17-22(28(33)34)15-16-25(26)32(3,4)5/h7-18H,6,19H2,1-5H3,(H3,33,34)