3-[(2-azanylsulfanylpurin-9-yl)-butoxycarbonyloxy-methoxy]propyl butyl carbonate

Systemtic Name: 3-[(2-azanylsulfanylpurin-9-yl)-butoxycarbonyloxy-methoxy]propyl butyl carbonate Openeye Name: 3-[(2-aminosulfanylpurin-9-yl)-butoxycarbonyloxy-methoxy]propyl butyl carbonate CAS Name: carbonic acid 3-[[2-(aminothio)-9-purinyl]-[butoxy(oxo)methoxy]methoxy]propyl butyl ester IUPAC Name: 3-[(2-aminosulfanylpurin-9-yl)-butoxycarbonyloxymethoxy]propyl butyl carbonate Traditional Name: carbonic acid 3-[[2-(aminothio)purin-9-yl]-butoxycarbonyloxy-methoxy]propyl butyl ester Formula: C19H29N5O7S MolecularWeight: 471.52786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)OCCCOC(N1C=NC2=CN=C(N=C21)SN)OC(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)OCCCOC(N1C=NC2=CN=C(N=C21)SN)OC(=O)OCCCC

InChI

InChI=1S/C19H29N5O7S/c1-3-5-8-28-18(25)29-11-7-10-27-17(31-19(26)30-9-6-4-2)24-13-22-14-12-21-16(32-20)23-15(14)24/h12-13,17H,3-11,20H2,1-2H3