1-(azetidin-1-yl)-2-(2,5-dimethylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(azetidin-1-yl)-2-(2,5-dimethylphenyl)sulfanyl-ethanone Openeye Name: 1-(azetidin-1-yl)-2-(2,5-dimethylphenyl)sulfanyl-ethanone CAS Name: 1-(1-azetidinyl)-2-[(2,5-dimethylphenyl)thio]ethanone IUPAC Name: 1-(azetidin-1-yl)-2-(2,5-dimethylphenyl)sulfanylethanone Traditional Name: 1-(azetidin-1-yl)-2-[(2,5-dimethylphenyl)thio]ethanone Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)N2CCC2

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)N2CCC2

InChI

InChI=1S/C13H17NOS/c1-10-4-5-11(2)12(8-10)16-9-13(15)14-6-3-7-14/h4-5,8H,3,6-7,9H2,1-2H3