[3,4,5-tris(butylcarbamoyloxy)-6-sulfanyl-oxan-2-yl]methyl N-butylcarbamate

Systemtic Name: [3,4,5-tris(butylcarbamoyloxy)-6-sulfanyl-oxan-2-yl]methyl N-butylcarbamate Openeye Name: [3,4,5-tris(butylcarbamoyloxy)-6-sulfanyl-tetrahydropyran-2-yl]methyl N-butylcarbamate CAS Name: N-butylcarbamic acid [3,4,5-tris[butylamino(oxo)methoxy]-6-mercapto-2-oxanyl]methyl ester IUPAC Name: [3,4,5-tris(butylcarbamoyloxy)-6-sulfanyloxan-2-yl]methyl N-butylcarbamate Traditional Name: N-butylcarbamic acid [3,4,5-tris(butylcarbamoyloxy)-6-mercapto-tetrahydropyran-2-yl]methyl ester Formula: C26H48N4O9S MolecularWeight: 592.74572

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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)