5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-[6-(triphenylmethyl)sulfanylhexoxy]oxolan-3-ol

Systemtic Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-[6-(triphenylmethyl)sulfanylhexoxy]oxolan-3-ol Openeye Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-(6-tritylsulfanylhexoxy)tetrahydrofuran-3-ol CAS Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-[6-[(triphenylmethyl)thio]hexoxy]-3-oxolanol IUPAC Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-(6-tritylsulfanylhexoxy)oxolan-3-ol Traditional Name: 5-adenin-9-yl-2-methylol-4-[6-(tritylthio)hexoxy]tetrahydrofuran-3-ol Formula: C35H39N5O4S MolecularWeight: 625.78026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCCCCCCOC4C(C(OC4N5C=NC6=C5N=CN=C6N)CO)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)SCCCCCCOC4C(C(OC4N5C=NC6=C5N=CN=C6N)CO)O

InChI

InChI=1S/C35H39N5O4S/c36-32-29-33(38-23-37-32)40(24-39-29)34-31(30(42)28(22-41)44-34)43-20-12-1-2-13-21-45-35(25-14-6-3-7-15-25,26-16-8-4-9-17-26)27-18-10-5-11-19-27/h3-11,14-19,23-24,28,30-31,34,41-42H,1-2,12-13,20-22H2,(H2,36,37,38)