1-[5-chloranyl-3-[(2,5-dimethylphenyl)sulfanylmethyl]-2-oxidanyl-phenyl]ethanone

Systemtic Name: 1-[5-chloranyl-3-[(2,5-dimethylphenyl)sulfanylmethyl]-2-oxidanyl-phenyl]ethanone Openeye Name: 1-[5-chloro-3-[(2,5-dimethylphenyl)sulfanylmethyl]-2-hydroxy-phenyl]ethanone CAS Name: 1-[5-chloro-3-[[(2,5-dimethylphenyl)thio]methyl]-2-hydroxyphenyl]ethanone IUPAC Name: 1-[5-chloro-3-[(2,5-dimethylphenyl)sulfanylmethyl]-2-hydroxyphenyl]ethanone Traditional Name: 1-[5-chloro-3-[[(2,5-dimethylphenyl)thio]methyl]-2-hydroxy-phenyl]ethanone Formula: C17H17ClO2S MolecularWeight: 320.83368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC2=C(C(=CC(=C2)Cl)C(=O)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC2=C(C(=CC(=C2)Cl)C(=O)C)O

InChI

InChI=1S/C17H17ClO2S/c1-10-4-5-11(2)16(6-10)21-9-13-7-14(18)8-15(12(3)19)17(13)20/h4-8,20H,9H2,1-3H3