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

Systemtic Name: 3-[[6-(3-carbamimidoyl-5-phenoxy-phenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[6-(3-carbamimidoyl-5-phenoxy-phenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[6-(3-carbamimidoyl-5-phenoxyphenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[6-(3-carbamimidoyl-5-phenoxyphenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[6-(3-amidino-5-phenoxy-phenoxy)-8-methyl-7H-purin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C28H25N7O4 MolecularWeight: 523.5426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=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

CC1=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/C28H25N7O4/c1-16-31-23-25(32-16)33-28(39-20-11-7-8-17(12-20)27(36)35(2)3)34-26(23)38-22-14-18(24(29)30)13-21(15-22)37-19-9-5-4-6-10-19/h4-15H,1-3H3,(H3,29,30)(H,31,32,33,34)