5-[6-azanyl-2-[3-(4-pyrrolidin-1-ylcarbonylcyclohexyl)prop-1-ynyl]purin-9-yl]-N-ethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide

Systemtic Name: 5-[6-azanyl-2-[3-(4-pyrrolidin-1-ylcarbonylcyclohexyl)prop-1-ynyl]purin-9-yl]-N-ethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: 5-[6-amino-2-[3-[4-(pyrrolidine-1-carbonyl)cyclohexyl]prop-1-ynyl]purin-9-yl]-N-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide CAS Name: 5-[6-amino-2-[3-[4-[oxo(1-pyrrolidinyl)methyl]cyclohexyl]prop-1-ynyl]-9-purinyl]-N-ethyl-3,4-dihydroxy-2-oxolanecarboxamide IUPAC Name: 5-[6-amino-2-[3-[4-(pyrrolidine-1-carbonyl)cyclohexyl]prop-1-ynyl]purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide Traditional Name: 5-[6-amino-2-[3-[4-(pyrrolidine-1-carbonyl)cyclohexyl]prop-1-ynyl]purin-9-yl]-N-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide Formula: C26H35N7O5 MolecularWeight: 525.6

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3N)C#CCC4CCC(CC4)C(=O)N5CCCC5)O)O

Isomeric SMILES

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3N)C#CCC4CCC(CC4)C(=O)N5CCCC5)O)O

InChI

InChI=1S/C26H35N7O5/c1-2-28-24(36)21-19(34)20(35)26(38-21)33-14-29-18-22(27)30-17(31-23(18)33)7-5-6-15-8-10-16(11-9-15)25(37)32-12-3-4-13-32/h14-16,19-21,26,34-35H,2-4,6,8-13H2,1H3,(H,28,36)(H2,27,30,31)