3-(6-aminopurin-9-yl)-N-[10-[3-(6-aminopurin-9-yl)propanoylamino]decyl]propanamide

Systemtic Name: 3-(6-aminopurin-9-yl)-N-[10-[3-(6-aminopurin-9-yl)propanoylamino]decyl]propanamide Openeye Name: 3-(6-aminopurin-9-yl)-N-[10-[3-(6-aminopurin-9-yl)propanoylamino]decyl]propanamide CAS Name: 3-(6-aminopurin-9-yl)-N-[10-[[3-(6-aminopurin-9-yl)-1-oxopropyl]amino]decyl]propanamide IUPAC Name: 3-(6-aminopurin-9-yl)-N-[10-[3-(6-aminopurin-9-yl)propanoylamino]decyl]propanamide Traditional Name: 3-adenin-9-yl-N-[10-(3-adenin-9-ylpropanoylamino)decyl]propionamide Formula: C26H38N12O2 MolecularWeight: 550.65912

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCC(=O)NCCCCCCCCCCNC(=O)CCN3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCC(=O)NCCCCCCCCCCNC(=O)CCN3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C26H38N12O2/c27-23-21-25(33-15-31-23)37(17-35-21)13-9-19(39)29-11-7-5-3-1-2-4-6-8-12-30-20(40)10-14-38-18-36-22-24(28)32-16-34-26(22)38/h15-18H,1-14H2,(H,29,39)(H,30,40)(H2,27,31,33)(H2,28,32,34)