5-[6-azanyl-2-[2-(1-azanylcyclohexyl)ethynyl]purin-9-yl]-N-ethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide

Systemtic Name: 5-[6-azanyl-2-[2-(1-azanylcyclohexyl)ethynyl]purin-9-yl]-N-ethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: 5-[6-amino-2-[2-(1-aminocyclohexyl)ethynyl]purin-9-yl]-N-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide CAS Name: 5-[6-amino-2-[2-(1-aminocyclohexyl)ethynyl]-9-purinyl]-N-ethyl-3,4-dihydroxy-2-oxolanecarboxamide IUPAC Name: 5-[6-amino-2-[2-(1-aminocyclohexyl)ethynyl]purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide Traditional Name: 5-[6-amino-2-[2-(1-aminocyclohexyl)ethynyl]purin-9-yl]-N-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide Formula: C20H27N7O4 MolecularWeight: 429.47288

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3N)C#CC4(CCCCC4)N)O)O

Isomeric SMILES

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3N)C#CC4(CCCCC4)N)O)O

InChI

InChI=1S/C20H27N7O4/c1-2-23-18(30)15-13(28)14(29)19(31-15)27-10-24-12-16(21)25-11(26-17(12)27)6-9-20(22)7-4-3-5-8-20/h10,13-15,19,28-29H,2-5,7-8,22H2,1H3,(H,23,30)(H2,21,25,26)