dimethyl 2-[[(4-methylphenyl)sulfonylamino]-methylsulfanyl-methylidene]propanedioate

Systemtic Name: dimethyl 2-[[(4-methylphenyl)sulfonylamino]-methylsulfanyl-methylidene]propanedioate Openeye Name: dimethyl 2-[methylsulfanyl-(p-tolylsulfonylamino)methylene]propanedioate CAS Name: 2-[[(4-methylphenyl)sulfonylamino]-(methylthio)methylidene]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[(4-methylphenyl)sulfonylamino]-methylsulfanylmethylidene]propanedioate Traditional Name: 2-[(methylthio)-(tosylamino)methylene]malonic acid dimethyl ester Formula: C14H17NO6S2 MolecularWeight: 359.41788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=C(C(=O)OC)C(=O)OC)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=C(C(=O)OC)C(=O)OC)SC

InChI

InChI=1S/C14H17NO6S2/c1-9-5-7-10(8-6-9)23(18,19)15-12(22-4)11(13(16)20-2)14(17)21-3/h5-8,15H,1-4H3