methyl (Z)-4-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-2,3-bis(sulfanyl)but-2-enoate

Systemtic Name: methyl (Z)-4-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-2,3-bis(sulfanyl)but-2-enoate Openeye Name: methyl (Z)-4-oxo-4-(p-tolylsulfonylamino)-2,3-bis(sulfanyl)but-2-enoate CAS Name: (Z)-2,3-dimercapto-4-[(4-methylphenyl)sulfonylamino]-4-oxo-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-4-[(4-methylphenyl)sulfonylamino]-4-oxo-2,3-bis(sulfanyl)but-2-enoate Traditional Name: (Z)-4-keto-2,3-dimercapto-4-(tosylamino)but-2-enoic acid methyl ester Formula: C12H13NO5S3 MolecularWeight: 347.43032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5S3/c1-7-3-5-8(6-4-7)21(16,17)13-11(14)9(19)10(20)12(15)18-2/h3-6,19-20H,1-2H3,(H,13,14)/b10-9-