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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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