2-bromanyl-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-methyl-propanamide

Systemtic Name: 2-bromanyl-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-methyl-propanamide Openeye Name: 2-bromo-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-methyl-propanamide CAS Name: 2-bromo-N-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-methylpropanamide IUPAC Name: 2-bromo-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-methylpropanamide Traditional Name: 2-bromo-N-[5-[(4-fluorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-2-methyl-propionamide Formula: C13H13BrFN3OS2 MolecularWeight: 390.294223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13BrFN3OS2/c1-13(2,14)10(19)16-11-17-18-12(21-11)20-7-8-3-5-9(15)6-4-8/h3-6H,7H2,1-2H3,(H,16,17,19)