N-(4-bromanyl-2-fluoranyl-phenyl)-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-(4-bromo-2-fluoro-phenyl)benzofuran-2-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-[(phenylmethylthio)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-(4-bromo-2-fluorophenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-(4-bromo-2-fluoro-phenyl)coumarilamide Formula: C23H17BrFNO2S MolecularWeight: 470.353983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C23H17BrFNO2S/c24-16-10-11-20(19(25)12-16)26-23(27)22-18(17-8-4-5-9-21(17)28-22)14-29-13-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,26,27)