[4-[[2,5-bis(fluoranyl)phenyl]sulfonylamino]-3-bromanyl-phenyl] thiocyanate

Systemtic Name: [4-[[2,5-bis(fluoranyl)phenyl]sulfonylamino]-3-bromanyl-phenyl] thiocyanate Openeye Name: [3-bromo-4-[(2,5-difluorophenyl)sulfonylamino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-bromo-4-[(2,5-difluorophenyl)sulfonylamino]phenyl] ester IUPAC Name: [3-bromo-4-[(2,5-difluorophenyl)sulfonylamino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-bromo-4-[(2,5-difluorophenyl)sulfonylamino]phenyl] ester Formula: C13H7BrF2N2O2S2 MolecularWeight: 405.237686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)Br)F

Isomeric SMILES

C1=CC(=C(C=C1F)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)Br)F

InChI

InChI=1S/C13H7BrF2N2O2S2/c14-10-6-9(21-7-17)2-4-12(10)18-22(19,20)13-5-8(15)1-3-11(13)16/h1-6,18H