(E)-2-ethyl-3-(1,3,4-thiadiazol-2-ylcarbamoyl)but-2-enedioic acid

Systemtic Name: (E)-2-ethyl-3-(1,3,4-thiadiazol-2-ylcarbamoyl)but-2-enedioic acid Openeye Name: (E)-2-ethyl-3-(1,3,4-thiadiazol-2-ylcarbamoyl)but-2-enedioic acid CAS Name: (E)-2-ethyl-3-[oxo-(1,3,4-thiadiazol-2-ylamino)methyl]-2-butenedioic acid IUPAC Name: (E)-2-ethyl-3-(1,3,4-thiadiazol-2-ylcarbamoyl)but-2-enedioic acid Traditional Name: (E)-2-ethyl-3-(1,3,4-thiadiazol-2-ylcarbamoyl)but-2-enedioic acid Formula: C9H9N3O5S MolecularWeight: 271.24986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C(=O)NC1=NN=CS1)C(=O)O)C(=O)O

Isomeric SMILES

CC/C(=C(/C(=O)NC1=NN=CS1)\C(=O)O)/C(=O)O

InChI

InChI=1S/C9H9N3O5S/c1-2-4(7(14)15)5(8(16)17)6(13)11-9-12-10-3-18-9/h3H,2H2,1H3,(H,14,15)(H,16,17)(H,11,12,13)/b5-4+