N-[7-[2-[2-(2-benzamido-6-oxidanylidene-3H-purin-7-yl)ethylamino]ethyl]-6-oxidanylidene-3H-purin-2-yl]benzamide

Systemtic Name: N-[7-[2-[2-(2-benzamido-6-oxidanylidene-3H-purin-7-yl)ethylamino]ethyl]-6-oxidanylidene-3H-purin-2-yl]benzamide Openeye Name: N-[7-[2-[2-(2-benzamido-6-oxo-3H-purin-7-yl)ethylamino]ethyl]-6-oxo-3H-purin-2-yl]benzamide CAS Name: N-[7-[2-[2-(2-benzamido-6-oxo-3H-purin-7-yl)ethylamino]ethyl]-6-oxo-3H-purin-2-yl]benzamide IUPAC Name: N-[7-[2-[2-(2-benzamido-6-oxo-3H-purin-7-yl)ethylamino]ethyl]-6-oxo-3H-purin-2-yl]benzamide Traditional Name: N-[7-[2-[2-(2-benzamido-6-keto-3H-purin-7-yl)ethylamino]ethyl]-6-keto-3H-purin-2-yl]benzamide Formula: C28H25N11O4 MolecularWeight: 579.5694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC(=O)C3=C(N2)N=CN3CCNCCN4C=NC5=C4C(=O)N=C(N5)NC(=O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC(=O)C3=C(N2)N=CN3CCNCCN4C=NC5=C4C(=O)N=C(N5)NC(=O)C6=CC=CC=C6

InChI

InChI=1S/C28H25N11O4/c40-23(17-7-3-1-4-8-17)34-27-32-21-19(25(42)36-27)38(15-30-21)13-11-29-12-14-39-16-31-22-20(39)26(43)37-28(33-22)35-24(41)18-9-5-2-6-10-18/h1-10,15-16,29H,11-14H2,(H2,32,34,36,40,42)(H2,33,35,37,41,43)