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

Systemtic Name: 2-methyl-5-methylsulfonyl-4-pyrimidin-2-ylsulfanyl-benzoyl chloride Openeye Name: 2-methyl-5-methylsulfonyl-4-pyrimidin-2-ylsulfanyl-benzoyl chloride CAS Name: 2-methyl-5-methylsulfonyl-4-(2-pyrimidinylthio)benzoyl chloride IUPAC Name: 2-methyl-5-methylsulfonyl-4-pyrimidin-2-ylsulfanylbenzoyl chloride Traditional Name: 5-mesyl-2-methyl-4-(2-pyrimidylthio)benzoyl chloride Formula: C13H11ClN2O3S2 MolecularWeight: 342.82104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)SC2=NC=CC=N2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)SC2=NC=CC=N2

InChI

InChI=1S/C13H11ClN2O3S2/c1-8-6-10(20-13-15-4-3-5-16-13)11(21(2,18)19)7-9(8)12(14)17/h3-7H,1-2H3