3-(cyclohexylsulfanylmethyl)-N-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-[4-(trifluoromethyl)phenyl]benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-[4-(trifluoromethyl)phenyl]-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-[4-(trifluoromethyl)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-[4-(trifluoromethyl)phenyl]coumarilamide Formula: C23H22F3NO2S MolecularWeight: 433.48649

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22F3NO2S/c24-23(25,26)15-10-12-16(13-11-15)27-22(28)21-19(14-30-17-6-2-1-3-7-17)18-8-4-5-9-20(18)29-21/h4-5,8-13,17H,1-3,6-7,14H2,(H,27,28)