N-[6-azido-9-(3-fluoranyl-2-oxidanyl-propyl)purin-2-yl]benzamide

Systemtic Name: N-[6-azido-9-(3-fluoranyl-2-oxidanyl-propyl)purin-2-yl]benzamide Openeye Name: N-[6-azido-9-(3-fluoro-2-hydroxy-propyl)purin-2-yl]benzamide CAS Name: N-[6-azido-9-(3-fluoro-2-hydroxypropyl)-2-purinyl]benzamide IUPAC Name: N-[6-azido-9-(3-fluoro-2-hydroxypropyl)purin-2-yl]benzamide Traditional Name: N-[6-azido-9-(3-fluoro-2-hydroxy-propyl)purin-2-yl]benzamide Formula: C15H13FN8O2 MolecularWeight: 356.314523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC(=C3C(=N2)N(C=N3)CC(CF)O)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC(=C3C(=N2)N(C=N3)CC(CF)O)N=[N+]=[N-]

InChI

InChI=1S/C15H13FN8O2/c16-6-10(25)7-24-8-18-11-12(22-23-17)19-15(20-13(11)24)21-14(26)9-4-2-1-3-5-9/h1-5,8,10,25H,6-7H2,(H,19,20,21,26)