(E)-but-2-enedioic acid; 2-sulfanylethanamide

Systemtic Name: (E)-but-2-enedioic acid; 2-sulfanylethanamide Openeye Name: fumaric acid; 2-sulfanylacetamide CAS Name: (E)-2-butenedioic acid; 2-mercaptoacetamide IUPAC Name: (E)-but-2-enedioic acid; 2-sulfanylacetamide Traditional Name: fumaric acid; 2-mercaptoacetamide Formula: C6H9NO5S MolecularWeight: 207.20436

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)N)S.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C(C(=O)N)S.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C4H4O4.C2H5NOS/c5-3(6)1-2-4(7)8;3-2(4)1-5/h1-2H,(H,5,6)(H,7,8);5H,1H2,(H2,3,4)/b2-1+;