3-(cyclohexylsulfanylmethyl)-N-[2,3,4-tris(fluoranyl)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-[2,3,4-tris(fluoranyl)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-(2,3,4-trifluorophenyl)benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-(2,3,4-trifluorophenyl)-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-(2,3,4-trifluorophenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-(2,3,4-trifluorophenyl)coumarilamide Formula: C22H20F3NO2S MolecularWeight: 419.45991

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4=C(C(=C(C=C4)F)F)F

Isomeric SMILES

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4=C(C(=C(C=C4)F)F)F

InChI

InChI=1S/C22H20F3NO2S/c23-16-10-11-17(20(25)19(16)24)26-22(27)21-15(12-29-13-6-2-1-3-7-13)14-8-4-5-9-18(14)28-21/h4-5,8-11,13H,1-3,6-7,12H2,(H,26,27)