5-fluoranyl-N-[(4-phenoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-fluoranyl-N-[(4-phenoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: 5-fluoro-N-[(4-phenoxyphenyl)carbamothioyl]benzofuran-2-carboxamide CAS Name: 5-fluoro-N-[(4-phenoxyanilino)-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: 5-fluoro-N-[(4-phenoxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: 5-fluoro-N-[(4-phenoxyphenyl)thiocarbamoyl]coumarilamide Formula: C22H15FN2O3S MolecularWeight: 406.429503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=C(O3)C=CC(=C4)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=C(O3)C=CC(=C4)F

InChI

InChI=1S/C22H15FN2O3S/c23-15-6-11-19-14(12-15)13-20(28-19)21(26)25-22(29)24-16-7-9-18(10-8-16)27-17-4-2-1-3-5-17/h1-13H,(H2,24,25,26,29)