5-tert-butyl-2,2-dimethyl-5-[(phenylmethylsulfanyl)methyl]-1,3-dioxane

Systemtic Name: 5-tert-butyl-2,2-dimethyl-5-[(phenylmethylsulfanyl)methyl]-1,3-dioxane Openeye Name: 5-(benzylsulfanylmethyl)-5-tert-butyl-2,2-dimethyl-1,3-dioxane CAS Name: 5-tert-butyl-2,2-dimethyl-5-[(phenylmethylthio)methyl]-1,3-dioxane IUPAC Name: 5-(benzylsulfanylmethyl)-5-tert-butyl-2,2-dimethyl-1,3-dioxane Traditional Name: 5-[(benzylthio)methyl]-5-tert-butyl-2,2-dimethyl-1,3-dioxane Formula: C18H28O2S MolecularWeight: 308.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(CSCC2=CC=CC=C2)C(C)(C)C)C

Isomeric SMILES

CC1(OCC(CO1)(CSCC2=CC=CC=C2)C(C)(C)C)C

InChI

InChI=1S/C18H28O2S/c1-16(2,3)18(12-19-17(4,5)20-13-18)14-21-11-15-9-7-6-8-10-15/h6-10H,11-14H2,1-5H3