N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-1,1-bis(oxidanylidene)thian-4-amine

Systemtic Name: N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-1,1-dioxo-thian-4-amine CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-1,1-dioxothian-4-amine Traditional Name: (3-bromo-4-fluoro-benzyl)-(1,1-diketothian-4-yl)amine Formula: C12H15BrFNO2S MolecularWeight: 336.220403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NCC2=CC(=C(C=C2)F)Br

Isomeric SMILES

C1CS(=O)(=O)CCC1NCC2=CC(=C(C=C2)F)Br

InChI

InChI=1S/C12H15BrFNO2S/c13-11-7-9(1-2-12(11)14)8-15-10-3-5-18(16,17)6-4-10/h1-2,7,10,15H,3-6,8H2