2-(hydroxymethyl)-5-[6-(naphthalen-1-ylmethylamino)-2-phenylsulfanyl-purin-9-yl]oxolane-3,4-diol

Systemtic Name: 2-(hydroxymethyl)-5-[6-(naphthalen-1-ylmethylamino)-2-phenylsulfanyl-purin-9-yl]oxolane-3,4-diol Openeye Name: 2-(hydroxymethyl)-5-[6-(1-naphthylmethylamino)-2-phenylsulfanyl-purin-9-yl]tetrahydrofuran-3,4-diol CAS Name: 2-(hydroxymethyl)-5-[6-(1-naphthalenylmethylamino)-2-(phenylthio)-9-purinyl]oxolane-3,4-diol IUPAC Name: 2-(hydroxymethyl)-5-[6-(naphthalen-1-ylmethylamino)-2-phenylsulfanylpurin-9-yl]oxolane-3,4-diol Traditional Name: 2-methylol-5-[6-(1-naphthylmethylamino)-2-(phenylthio)purin-9-yl]tetrahydrofuran-3,4-diol Formula: C27H25N5O4S MolecularWeight: 515.5835

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC3=C(C(=N2)NCC4=CC=CC5=CC=CC=C54)N=CN3C6C(C(C(O6)CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC3=C(C(=N2)NCC4=CC=CC5=CC=CC=C54)N=CN3C6C(C(C(O6)CO)O)O

InChI

InChI=1S/C27H25N5O4S/c33-14-20-22(34)23(35)26(36-20)32-15-29-21-24(28-13-17-9-6-8-16-7-4-5-12-19(16)17)30-27(31-25(21)32)37-18-10-2-1-3-11-18/h1-12,15,20,22-23,26,33-35H,13-14H2,(H,28,30,31)