5-[1,3-dibutyl-2,6-bis(oxidanylidene)purin-7-yl]-3,4-bis(oxidanyl)oxolane-2-carboxamide

Systemtic Name: 5-[1,3-dibutyl-2,6-bis(oxidanylidene)purin-7-yl]-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: 5-(1,3-dibutyl-2,6-dioxo-purin-7-yl)-3,4-dihydroxy-tetrahydrofuran-2-carboxamide CAS Name: 5-(1,3-dibutyl-2,6-dioxo-7-purinyl)-3,4-dihydroxy-2-oxolanecarboxamide IUPAC Name: 5-(1,3-dibutyl-2,6-dioxopurin-7-yl)-3,4-dihydroxyoxolane-2-carboxamide Traditional Name: 5-(1,3-dibutyl-2,6-diketo-purin-7-yl)-3,4-dihydroxy-tetrahydrofuran-2-carboxamide Formula: C18H27N5O6 MolecularWeight: 409.43688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)C3C(C(C(O3)C(=O)N)O)O

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CCCC)N(C=N2)C3C(C(C(O3)C(=O)N)O)O

InChI

InChI=1S/C18H27N5O6/c1-3-5-7-21-15-10(16(27)22(18(21)28)8-6-4-2)23(9-20-15)17-12(25)11(24)13(29-17)14(19)26/h9,11-13,17,24-25H,3-8H2,1-2H3,(H2,19,26)