N2-(1-methylsulfanylpropan-2-yl)-3-methylsulfonyl-benzene-1,2-dicarboxamide

Systemtic Name: N2-(1-methylsulfanylpropan-2-yl)-3-methylsulfonyl-benzene-1,2-dicarboxamide Openeye Name: N2-(1-methyl-2-methylsulfanyl-ethyl)-3-methylsulfonyl-phthalamide CAS Name: 3-methylsulfonyl-N2-[1-(methylthio)propan-2-yl]benzene-1,2-dicarboxamide IUPAC Name: 2-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=C1S(=O)(=O)C)C(=O)N

Isomeric SMILES

CC(CSC)NC(=O)C1=C(C=CC=C1S(=O)(=O)C)C(=O)N

InChI

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