(4R,5S)-4-ethyl-2,2-dimethyl-5-[(4-methylphenyl)sulfonyl-methylsulfanyl-methyl]-1,3-dioxane

Systemtic Name: (4R,5S)-4-ethyl-2,2-dimethyl-5-[(4-methylphenyl)sulfonyl-methylsulfanyl-methyl]-1,3-dioxane Openeye Name: (4R,5S)-4-ethyl-2,2-dimethyl-5-[methylsulfanyl(p-tolylsulfonyl)methyl]-1,3-dioxane CAS Name: (4R,5S)-4-ethyl-2,2-dimethyl-5-[(4-methylphenyl)sulfonyl-(methylthio)methyl]-1,3-dioxane IUPAC Name: (4R,5S)-4-ethyl-2,2-dimethyl-5-[(4-methylphenyl)sulfonyl-methylsulfanylmethyl]-1,3-dioxane Traditional Name: (4R,5S)-4-ethyl-2,2-dimethyl-5-[(methylthio)-tosyl-methyl]-1,3-dioxane Formula: C17H26O4S2 MolecularWeight: 358.51594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(COC(O1)(C)C)C(SC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC[C@@H]1[C@H](COC(O1)(C)C)C(SC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H26O4S2/c1-6-15-14(11-20-17(3,4)21-15)16(22-5)23(18,19)13-9-7-12(2)8-10-13/h7-10,14-16H,6,11H2,1-5H3/t14-,15+,16?/m0/s1