3-[(5-bromanyl-2-fluoranyl-phenyl)methyl-phenyl-amino]propanethioamide

Systemtic Name: 3-[(5-bromanyl-2-fluoranyl-phenyl)methyl-phenyl-amino]propanethioamide Openeye Name: 3-[N-[(5-bromo-2-fluoro-phenyl)methyl]anilino]propanethioamide CAS Name: 3-[N-[(5-bromo-2-fluorophenyl)methyl]anilino]propanethioamide IUPAC Name: 3-[N-[(5-bromo-2-fluorophenyl)methyl]anilino]propanethioamide Traditional Name: 3-(N-(5-bromo-2-fluoro-benzyl)anilino)thiopropionamide Formula: C16H16BrFN2S MolecularWeight: 367.279043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC(=S)N)CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

C1=CC=C(C=C1)N(CCC(=S)N)CC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C16H16BrFN2S/c17-13-6-7-15(18)12(10-13)11-20(9-8-16(19)21)14-4-2-1-3-5-14/h1-7,10H,8-9,11H2,(H2,19,21)