N1-(1-methylsulfanylpropan-2-yl)-3-methylsulfonyl-benzene-1,2-dicarboxamide

Systemtic Name: N1-(1-methylsulfanylpropan-2-yl)-3-methylsulfonyl-benzene-1,2-dicarboxamide Openeye Name: N1-(1-methyl-2-methylsulfanyl-ethyl)-3-methylsulfonyl-phthalamide CAS Name: 3-methylsulfonyl-N1-[1-(methylthio)propan-2-yl]benzene-1,2-dicarboxamide IUPAC Name: 1-N-(1-methylsulfanylpropan-2-yl)-3-methylsulfonylbenzene-1,2-dicarboxamide Traditional Name: 3-mesyl-N-[1-methyl-2-(methylthio)ethyl]phthalamide Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC)NC(=O)C1=C(C(=CC=C1)S(=O)(=O)C)C(=O)N

Isomeric SMILES

CC(CSC)NC(=O)C1=C(C(=CC=C1)S(=O)(=O)C)C(=O)N

InChI

InChI=1S/C13H18N2O4S2/c1-8(7-20-2)15-13(17)9-5-4-6-10(21(3,18)19)11(9)12(14)16/h4-6,8H,7H2,1-3H3,(H2,14,16)(H,15,17)