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

Systemtic Name: 3-[(phenylmethylsulfanyl)methyl]-N-[4-(trifluoromethyloxy)phenyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-[4-(trifluoromethoxy)phenyl]benzofuran-2-carboxamide CAS Name: 3-[(phenylmethylthio)methyl]-N-[4-(trifluoromethoxy)phenyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-[4-(trifluoromethoxy)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-[4-(trifluoromethoxy)phenyl]coumarilamide Formula: C24H18F3NO3S MolecularWeight: 457.46483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H18F3NO3S/c25-24(26,27)31-18-12-10-17(11-13-18)28-23(29)22-20(19-8-4-5-9-21(19)30-22)15-32-14-16-6-2-1-3-7-16/h1-13H,14-15H2,(H,28,29)