N-[4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[3-(4-fluorophenyl)sulfanylpropanoylamino]methyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[3-[(4-fluorophenyl)thio]propanoylamino]methyl]phenyl]-2-furamide Formula: C21H19FN2O3S MolecularWeight: 398.450563

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)CNC(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)CNC(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN2O3S/c22-16-5-9-18(10-6-16)28-13-11-20(25)23-14-15-3-7-17(8-4-15)24-21(26)19-2-1-12-27-19/h1-10,12H,11,13-14H2,(H,23,25)(H,24,26)