N-cyclopropyl-3,4-bis(oxidanyl)-5-[6-[(phenylmethyl)amino]purin-9-yl]oxolane-2-carboxamide

Systemtic Name: N-cyclopropyl-3,4-bis(oxidanyl)-5-[6-[(phenylmethyl)amino]purin-9-yl]oxolane-2-carboxamide Openeye Name: 5-[6-(benzylamino)purin-9-yl]-N-cyclopropyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide CAS Name: N-cyclopropyl-3,4-dihydroxy-5-[6-[(phenylmethyl)amino]-9-purinyl]-2-oxolanecarboxamide IUPAC Name: 5-[6-(benzylamino)purin-9-yl]-N-cyclopropyl-3,4-dihydroxyoxolane-2-carboxamide Traditional Name: 5-[6-(benzylamino)purin-9-yl]-N-cyclopropyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide Formula: C20H22N6O4 MolecularWeight: 410.42648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2C(C(C(O2)N3C=NC4=C3N=CN=C4NCC5=CC=CC=C5)O)O

Isomeric SMILES

C1CC1NC(=O)C2C(C(C(O2)N3C=NC4=C3N=CN=C4NCC5=CC=CC=C5)O)O

InChI

InChI=1S/C20H22N6O4/c27-14-15(28)20(30-16(14)19(29)25-12-6-7-12)26-10-24-13-17(22-9-23-18(13)26)21-8-11-4-2-1-3-5-11/h1-5,9-10,12,14-16,20,27-28H,6-8H2,(H,25,29)(H,21,22,23)