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

Systemtic Name: 3-[[2-(5-carbamimidoyl-2-ethoxy-phenoxy)-8-methyl-7H-purin-6-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[2-(5-carbamimidoyl-2-ethoxy-phenoxy)-8-methyl-7H-purin-6-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[2-(5-carbamimidoyl-2-ethoxyphenoxy)-8-methyl-7H-purin-6-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[2-(5-carbamimidoyl-2-ethoxyphenoxy)-8-methyl-7H-purin-6-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[2-(5-amidino-2-ethoxy-phenoxy)-8-methyl-7H-purin-6-yl]oxy]-N,N-dimethyl-benzamide Formula: C24H25N7O4 MolecularWeight: 475.4998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=N)N)OC2=NC3=C(C(=N2)OC4=CC=CC(=C4)C(=O)N(C)C)NC(=N3)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=N)N)OC2=NC3=C(C(=N2)OC4=CC=CC(=C4)C(=O)N(C)C)NC(=N3)C

InChI

InChI=1S/C24H25N7O4/c1-5-33-17-10-9-14(20(25)26)12-18(17)35-24-29-21-19(27-13(2)28-21)22(30-24)34-16-8-6-7-15(11-16)23(32)31(3)4/h6-12H,5H2,1-4H3,(H3,25,26)(H,27,28,29,30)