(E)-2-cyano-3-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-2-cyano-3-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid Openeye Name: (E)-2-cyano-3-[2-(4-fluorophenyl)thiazol-4-yl]prop-2-enoic acid CAS Name: (E)-2-cyano-3-[2-(4-fluorophenyl)-4-thiazolyl]-2-propenoic acid IUPAC Name: (E)-2-cyano-3-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]prop-2-enoic acid Traditional Name: (E)-2-cyano-3-[2-(4-fluorophenyl)thiazol-4-yl]acrylic acid Formula: C13H7FN2O2S MolecularWeight: 274.270283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CS2)C=C(C#N)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CS2)/C=C(\C#N)/C(=O)O)F

InChI

InChI=1S/C13H7FN2O2S/c14-10-3-1-8(2-4-10)12-16-11(7-19-12)5-9(6-15)13(17)18/h1-5,7H,(H,17,18)/b9-5+