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

Systemtic Name: 5-[6-[(3-acetamidophenyl)methylamino]purin-9-yl]-N-methyl-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: 5-[6-[(3-acetamidophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyl-tetrahydrofuran-2-carboxamide CAS Name: 5-[6-[(3-acetamidophenyl)methylamino]-9-purinyl]-3,4-dihydroxy-N-methyl-2-oxolanecarboxamide IUPAC Name: 5-[6-[(3-acetamidophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide Traditional Name: 5-[6-[(3-acetamidobenzyl)amino]purin-9-yl]-3,4-dihydroxy-N-methyl-tetrahydrofuran-2-carboxamide Formula: C20H23N7O5 MolecularWeight: 441.44052

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)C(=O)NC)O)O

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)C(=O)NC)O)O

InChI

InChI=1S/C20H23N7O5/c1-10(28)26-12-5-3-4-11(6-12)7-22-17-13-18(24-8-23-17)27(9-25-13)20-15(30)14(29)16(32-20)19(31)21-2/h3-6,8-9,14-16,20,29-30H,7H2,1-2H3,(H,21,31)(H,26,28)(H,22,23,24)