5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(4-bromo-2-fluorophenyl)methylthio]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(4-bromo-2-fluorophenyl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-[(4-bromo-2-fluoro-benzyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C12H11BrFN3S2 MolecularWeight: 360.268243

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(S1)SCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C=CCNC1=NN=C(S1)SCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C12H11BrFN3S2/c1-2-5-15-11-16-17-12(19-11)18-7-8-3-4-9(13)6-10(8)14/h2-4,6H,1,5,7H2,(H,15,16)