2-methyl-5-methylsulfonyl-4-propan-2-ylsulfanyl-benzoyl chloride

Systemtic Name: 2-methyl-5-methylsulfonyl-4-propan-2-ylsulfanyl-benzoyl chloride Openeye Name: 4-isopropylsulfanyl-2-methyl-5-methylsulfonyl-benzoyl chloride CAS Name: 2-methyl-5-methylsulfonyl-4-(propan-2-ylthio)benzoyl chloride IUPAC Name: 2-methyl-5-methylsulfonyl-4-propan-2-ylsulfanylbenzoyl chloride Traditional Name: 4-(isopropylthio)-5-mesyl-2-methyl-benzoyl chloride Formula: C12H15ClO3S2 MolecularWeight: 306.8287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)SC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)SC(C)C

InChI

InChI=1S/C12H15ClO3S2/c1-7(2)17-10-5-8(3)9(12(13)14)6-11(10)18(4,15)16/h5-7H,1-4H3