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

Systemtic Name: [3,4,6-triacetyloxy-5-[(4-methoxyphenyl)carbamothioylamino]oxan-2-yl]methyl ethanoate Openeye Name: [3,4,6-triacetoxy-5-[(4-methoxyphenyl)carbamothioylamino]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4,6-triacetyloxy-5-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-2-oxanyl]methyl ester IUPAC Name: [3,4,6-triacetyloxy-5-[(4-methoxyphenyl)carbamothioylamino]oxan-2-yl]methyl acetate Traditional Name: acetic acid [3,4,6-triacetoxy-5-[(4-methoxyphenyl)thiocarbamoylamino]tetrahydropyran-2-yl]methyl ester Formula: C22H28N2O10S MolecularWeight: 512.53012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)OC(=O)C)NC(=S)NC2=CC=C(C=C2)OC)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OCC1C(C(C(C(O1)OC(=O)C)NC(=S)NC2=CC=C(C=C2)OC)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H28N2O10S/c1-11(25)30-10-17-19(31-12(2)26)20(32-13(3)27)18(21(34-17)33-14(4)28)24-22(35)23-15-6-8-16(29-5)9-7-15/h6-9,17-21H,10H2,1-5H3,(H2,23,24,35)