2-ethyl-5-methylsulfonyl-4-(pyrimidin-2-ylamino)benzoyl chloride

Systemtic Name: 2-ethyl-5-methylsulfonyl-4-(pyrimidin-2-ylamino)benzoyl chloride Openeye Name: 2-ethyl-5-methylsulfonyl-4-(pyrimidin-2-ylamino)benzoyl chloride CAS Name: 2-ethyl-5-methylsulfonyl-4-(2-pyrimidinylamino)benzoyl chloride IUPAC Name: 2-ethyl-5-methylsulfonyl-4-(pyrimidin-2-ylamino)benzoyl chloride Traditional Name: 2-ethyl-5-mesyl-4-(2-pyrimidylamino)benzoyl chloride Formula: C14H14ClN3O3S MolecularWeight: 339.79726

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)NC2=NC=CC=N2

Isomeric SMILES

CCC1=CC(=C(C=C1C(=O)Cl)S(=O)(=O)C)NC2=NC=CC=N2

InChI

InChI=1S/C14H14ClN3O3S/c1-3-9-7-11(18-14-16-5-4-6-17-14)12(22(2,20)21)8-10(9)13(15)19/h4-8H,3H2,1-2H3,(H,16,17,18)