(E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-fluoranyl-4-iodanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-fluoranyl-4-iodanyl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-fluoro-4-iodo-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-fluoro-4-iodophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-fluoro-4-iodophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-fluoro-4-iodo-phenyl)acrylamide Formula: C14H10FIN4OS MolecularWeight: 428.223273

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C(=CC2=C(C=C(C=C2)I)F)C#N

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)/C(=C/C2=C(C=C(C=C2)I)F)/C#N

InChI

InChI=1S/C14H10FIN4OS/c1-2-12-19-20-14(22-12)18-13(21)9(7-17)5-8-3-4-10(16)6-11(8)15/h3-6H,2H2,1H3,(H,18,20,21)/b9-5+