5-[2-azanyl-6-(phenylmethylsulfanyl)-7H-purin-8-yl]-4-fluoranyl-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-[2-azanyl-6-(phenylmethylsulfanyl)-7H-purin-8-yl]-4-fluoranyl-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-(2-amino-6-benzylsulfanyl-7H-purin-8-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-[2-amino-6-(phenylmethylthio)-7H-purin-8-yl]-4-fluoro-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-(2-amino-6-benzylsulfanyl-7H-purin-8-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-[2-amino-6-(benzylthio)-7H-purin-8-yl]-4-fluoro-2-methylol-tetrahydrofuran-3-ol Formula: C17H18FN5O3S MolecularWeight: 391.419923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=NC3=C2NC(=N3)C4C(C(C(O4)CO)O)F)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=NC3=C2NC(=N3)C4C(C(C(O4)CO)O)F)N

InChI

InChI=1S/C17H18FN5O3S/c18-10-12(25)9(6-24)26-13(10)15-20-11-14(21-15)22-17(19)23-16(11)27-7-8-4-2-1-3-5-8/h1-5,9-10,12-13,24-25H,6-7H2,(H3,19,20,21,22,23)