dimethyl (Z)-2-[(4-methylphenyl)sulfonylamino]sulfanyl-3-sulfanyl-but-2-enedioate

Systemtic Name: dimethyl (Z)-2-[(4-methylphenyl)sulfonylamino]sulfanyl-3-sulfanyl-but-2-enedioate Openeye Name: dimethyl (Z)-2-(p-tolylsulfonylamino)sulfanyl-3-sulfanyl-but-2-enedioate CAS Name: (Z)-2-mercapto-3-[[(4-methylphenyl)sulfonylamino]thio]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (Z)-2-[(4-methylphenyl)sulfonylamino]sulfanyl-3-sulfanylbut-2-enedioate Traditional Name: (Z)-2-mercapto-3-[(tosylamino)thio]but-2-enedioic acid dimethyl ester Formula: C13H15NO6S3 MolecularWeight: 377.4563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NSC(=C(C(=O)OC)S)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NS/C(=C(/C(=O)OC)\S)/C(=O)OC

InChI

InChI=1S/C13H15NO6S3/c1-8-4-6-9(7-5-8)23(17,18)14-22-11(13(16)20-3)10(21)12(15)19-2/h4-7,14,21H,1-3H3/b11-10-