3-[(2-azanyl-6-chloranyl-purin-9-yl)-decoxysulfanylcarbonyloxy-methoxy]propyl decoxysulfanylmethanoate

Systemtic Name: 3-[(2-azanyl-6-chloranyl-purin-9-yl)-decoxysulfanylcarbonyloxy-methoxy]propyl decoxysulfanylmethanoate Openeye Name: 3-[(2-amino-6-chloro-purin-9-yl)-decoxysulfanylcarbonyloxy-methoxy]propyl decoxysulfanylformate CAS Name: (decoxythio)formic acid 3-[(2-amino-6-chloro-9-purinyl)-[(decoxythio)-oxomethoxy]methoxy]propyl ester IUPAC Name: 3-[(2-amino-6-chloropurin-9-yl)-decoxysulfanylcarbonyloxymethoxy]propyl decoxysulfanylformate Traditional Name: (decoxythio)formic acid 3-[(2-amino-6-chloro-purin-9-yl)-(decoxythio)carbonyloxy-methoxy]propyl ester Formula: C31H52ClN5O7S2 MolecularWeight: 706.35688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOSC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2Cl)N)OC(=O)SOCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOSC(=O)OCCCOC(N1C=NC2=C1N=C(N=C2Cl)N)OC(=O)SOCCCCCCCCCC

InChI

InChI=1S/C31H52ClN5O7S2/c1-3-5-7-9-11-13-15-17-22-42-45-30(38)41-21-19-20-40-29(37-24-34-25-26(32)35-28(33)36-27(25)37)44-31(39)46-43-23-18-16-14-12-10-8-6-4-2/h24,29H,3-23H2,1-2H3,(H2,33,35,36)