5-[bis(fluoranyl)methylsulfanylmethyl]-N-[4-(3-methylbutanoylamino)phenyl]furan-2-carboxamide

Systemtic Name: 5-[bis(fluoranyl)methylsulfanylmethyl]-N-[4-(3-methylbutanoylamino)phenyl]furan-2-carboxamide Openeye Name: 5-(difluoromethylsulfanylmethyl)-N-[4-(3-methylbutanoylamino)phenyl]furan-2-carboxamide CAS Name: 5-[(difluoromethylthio)methyl]-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-furancarboxamide IUPAC Name: 5-(difluoromethylsulfanylmethyl)-N-[4-(3-methylbutanoylamino)phenyl]furan-2-carboxamide Traditional Name: 5-[(difluoromethylthio)methyl]-N-[4-(isovalerylamino)phenyl]-2-furamide Formula: C18H20F2N2O3S MolecularWeight: 382.424806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(O2)CSC(F)F

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(O2)CSC(F)F

InChI

InChI=1S/C18H20F2N2O3S/c1-11(2)9-16(23)21-12-3-5-13(6-4-12)22-17(24)15-8-7-14(25-15)10-26-18(19)20/h3-8,11,18H,9-10H2,1-2H3,(H,21,23)(H,22,24)