3-[[6-(3-carbamimidoyl-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide

Systemtic Name: 3-[[6-(3-carbamimidoyl-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[6-(3-carbamimidoyl-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[6-(3-carbamimidoyl-5-phenoxyphenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[6-(3-carbamimidoyl-5-phenoxyphenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[6-(3-amidino-5-phenoxy-phenoxy)-8-ethyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C29H27N7O4 MolecularWeight: 537.56918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC(=C3)C(=O)N(C)C)OC4=CC(=CC(=C4)OC5=CC=CC=C5)C(=N)N

Isomeric SMILES

CCC1=NC2=C(N1)C(=NC(=N2)OC3=CC=CC(=C3)C(=O)N(C)C)OC4=CC(=CC(=C4)OC5=CC=CC=C5)C(=N)N

InChI

InChI=1S/C29H27N7O4/c1-4-23-32-24-26(33-23)34-29(40-20-12-8-9-17(13-20)28(37)36(2)3)35-27(24)39-22-15-18(25(30)31)14-21(16-22)38-19-10-6-5-7-11-19/h5-16H,4H2,1-3H3,(H3,30,31)(H,32,33,34,35)