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

Systemtic Name: 5-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-N-isopropyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(4-bromo-2-fluorophenyl)methylthio]-N-propan-2-yl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(4-bromo-2-fluorophenyl)methylsulfanyl]-N-propan-2-yl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(4-bromo-2-fluoro-benzyl)thio]-1,3,4-thiadiazol-2-yl]-isopropyl-amine Formula: C12H13BrFN3S2 MolecularWeight: 362.284123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN=C(S1)SCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(C)NC1=NN=C(S1)SCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C12H13BrFN3S2/c1-7(2)15-11-16-17-12(19-11)18-6-8-3-4-9(13)5-10(8)14/h3-5,7H,6H2,1-2H3,(H,15,16)