(E)-3-(5-bromanyl-2-fluoranyl-phenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-fluoranyl-phenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(5-bromo-2-fluoro-phenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-fluorophenyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-3-(5-bromo-2-fluoro-phenyl)acrylamide Formula: C14H11BrFN3OS2 MolecularWeight: 400.289043

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(S1)NC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C=CCSC1=NN=C(S1)NC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C14H11BrFN3OS2/c1-2-7-21-14-19-18-13(22-14)17-12(20)6-3-9-8-10(15)4-5-11(9)16/h2-6,8H,1,7H2,(H,17,18,20)/b6-3+