1-(2-ethyl-2-methyl-thian-4-yl)hexan-1-one

Systemtic Name: 1-(2-ethyl-2-methyl-thian-4-yl)hexan-1-one Openeye Name: 1-(2-ethyl-2-methyl-tetrahydrothiopyran-4-yl)hexan-1-one CAS Name: 1-(2-ethyl-2-methyl-4-thianyl)-1-hexanone IUPAC Name: 1-(2-ethyl-2-methylthian-4-yl)hexan-1-one Traditional Name: 1-(2-ethyl-2-methyl-tetrahydrothiopyran-4-yl)hexan-1-one Formula: C14H26OS MolecularWeight: 242.42064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1CCSC(C1)(C)CC

Isomeric SMILES

CCCCCC(=O)C1CCSC(C1)(C)CC

InChI

InChI=1S/C14H26OS/c1-4-6-7-8-13(15)12-9-10-16-14(3,5-2)11-12/h12H,4-11H2,1-3H3