N-[[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[[4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]phenyl]carbamothioyl]-2-fluoranyl-benzamide Openeye Name: N-[[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]carbamothioyl]-2-fluoro-benzamide CAS Name: N-[[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]anilino]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: N-[[4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]phenyl]carbamothioyl]-2-fluorobenzamide Traditional Name: N-[[4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]phenyl]thiocarbamoyl]-2-fluoro-benzamide Formula: C22H19BrFN3O4S2 MolecularWeight: 552.436363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H19BrFN3O4S2/c1-2-31-19-12-7-14(23)13-20(19)33(29,30)27-16-10-8-15(9-11-16)25-22(32)26-21(28)17-5-3-4-6-18(17)24/h3-13,27H,2H2,1H3,(H2,25,26,28,32)