dimethyl (Z)-2-(2-aminocarbonylphenyl)sulfanylbut-2-enedioate

Systemtic Name: dimethyl (Z)-2-(2-aminocarbonylphenyl)sulfanylbut-2-enedioate Openeye Name: dimethyl (Z)-2-(2-carbamoylphenyl)sulfanylbut-2-enedioate CAS Name: (Z)-2-[(2-carbamoylphenyl)thio]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (Z)-2-(2-carbamoylphenyl)sulfanylbut-2-enedioate Traditional Name: (Z)-2-[(2-carbamoylphenyl)thio]but-2-enedioic acid dimethyl ester Formula: C13H13NO5S MolecularWeight: 295.31102

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)SC1=CC=CC=C1C(=O)N

Isomeric SMILES

COC(=O)/C=C(/C(=O)OC)\SC1=CC=CC=C1C(=O)N

InChI

InChI=1S/C13H13NO5S/c1-18-11(15)7-10(13(17)19-2)20-9-6-4-3-5-8(9)12(14)16/h3-7H,1-2H3,(H2,14,16)/b10-7-