N-methyl-3,4-bis(oxidanyl)-5-[6-(pentan-3-ylamino)purin-9-yl]oxolane-2-carboxamide

Systemtic Name: N-methyl-3,4-bis(oxidanyl)-5-[6-(pentan-3-ylamino)purin-9-yl]oxolane-2-carboxamide Openeye Name: 5-[6-(1-ethylpropylamino)purin-9-yl]-3,4-dihydroxy-N-methyl-tetrahydrofuran-2-carboxamide CAS Name: 3,4-dihydroxy-N-methyl-5-[6-(pentan-3-ylamino)-9-purinyl]-2-oxolanecarboxamide IUPAC Name: 3,4-dihydroxy-N-methyl-5-[6-(pentan-3-ylamino)purin-9-yl]oxolane-2-carboxamide Traditional Name: 5-[6-(1-ethylpropylamino)purin-9-yl]-3,4-dihydroxy-N-methyl-tetrahydrofuran-2-carboxamide Formula: C16H24N6O4 MolecularWeight: 364.39956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=NC=NC2=C1N=CN2C3C(C(C(O3)C(=O)NC)O)O

Isomeric SMILES

CCC(CC)NC1=NC=NC2=C1N=CN2C3C(C(C(O3)C(=O)NC)O)O

InChI

InChI=1S/C16H24N6O4/c1-4-8(5-2)21-13-9-14(19-6-18-13)22(7-20-9)16-11(24)10(23)12(26-16)15(25)17-3/h6-8,10-12,16,23-24H,4-5H2,1-3H3,(H,17,25)(H,18,19,21)