3,4,5-tris(butylcarbamoyloxy)-6-(butylcarbamoyloxymethyl)oxane-2-thiolate

Systemtic Name: 3,4,5-tris(butylcarbamoyloxy)-6-(butylcarbamoyloxymethyl)oxane-2-thiolate Openeye Name: 3,4,5-tris(butylcarbamoyloxy)-6-(butylcarbamoyloxymethyl)tetrahydropyran-2-thiolate CAS Name: 3,4,5-tris[butylamino(oxo)methoxy]-6-[[butylamino(oxo)methoxy]methyl]-2-oxanethiolate IUPAC Name: 3,4,5-tris(butylcarbamoyloxy)-6-(butylcarbamoyloxymethyl)oxane-2-thiolate Traditional Name: 3,4,5-tris(butylcarbamoyloxy)-6-(butylcarbamoyloxymethyl)tetrahydropyran-2-thiolate Formula: C26H47N4O9S- MolecularWeight: 591.73778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)OCC1C(C(C(C(O1)[S-])OC(=O)NCCCC)OC(=O)NCCCC)OC(=O)NCCCC

Isomeric SMILES

CCCCNC(=O)OCC1C(C(C(C(O1)[S-])OC(=O)NCCCC)OC(=O)NCCCC)OC(=O)NCCCC

InChI

InChI=1S/C26H48N4O9S/c1-5-9-13-27-23(31)35-17-18-19(37-24(32)28-14-10-6-2)20(38-25(33)29-15-11-7-3)21(22(40)36-18)39-26(34)30-16-12-8-4/h18-22,40H,5-17H2,1-4H3,(H,27,31)(H,28,32)(H,29,33)(H,30,34)/p-1