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

Systemtic Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(cyclohexylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-3-[(cyclohexylthio)methyl]coumarilamide Formula: C25H25F3N2O3S MolecularWeight: 490.53781

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4CCCCC4)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4CCCCC4)C(F)(F)F

InChI

InChI=1S/C25H25F3N2O3S/c1-15(31)29-16-11-12-21(20(13-16)25(26,27)28)30-24(32)23-19(14-34-17-7-3-2-4-8-17)18-9-5-6-10-22(18)33-23/h5-6,9-13,17H,2-4,7-8,14H2,1H3,(H,29,31)(H,30,32)