[3,4,5-triacetyloxy-6-(phenacylcarbamothioylamino)oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4,5-triacetyloxy-6-(phenacylcarbamothioylamino)oxan-2-yl]methyl ethanoate Openeye Name: [3,4,5-triacetoxy-6-(phenacylcarbamothioylamino)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,5-triacetyloxy-6-[[(phenacylamino)-sulfanylidenemethyl]amino]-2-oxanyl]methyl ester IUPAC Name: [3,4,5-triacetyloxy-6-(phenacylcarbamothioylamino)oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,5-triacetoxy-6-(phenacylthiocarbamoylamino)tetrahydropyran-2-yl]methyl ester Formula: C23H28N2O10S MolecularWeight: 524.54082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)NC(=S)NCC(=O)C2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)NC(=S)NCC(=O)C2=CC=CC=C2)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C23H28N2O10S/c1-12(26)31-11-18-19(32-13(2)27)20(33-14(3)28)21(34-15(4)29)22(35-18)25-23(36)24-10-17(30)16-8-6-5-7-9-16/h5-9,18-22H,10-11H2,1-4H3,(H2,24,25,36)