4-fluoranyl-N-[(E)-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]benzamide

Systemtic Name: 4-fluoranyl-N-[(E)-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]benzamide Openeye Name: 4-fluoro-N-[(E)-[3-(2-furylmethylsulfanylmethyl)-4-methoxy-phenyl]methyleneamino]benzamide CAS Name: 4-fluoro-N-[(E)-[3-[(2-furanylmethylthio)methyl]-4-methoxyphenyl]methylideneamino]benzamide IUPAC Name: 4-fluoro-N-[(E)-[3-(furan-2-ylmethylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]benzamide Traditional Name: 4-fluoro-N-[(E)-[3-[(2-furfurylthio)methyl]-4-methoxy-benzylidene]amino]benzamide Formula: C21H19FN2O3S MolecularWeight: 398.450563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=C(C=C2)F)CSCC3=CC=CO3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC=C(C=C2)F)CSCC3=CC=CO3

InChI

InChI=1S/C21H19FN2O3S/c1-26-20-9-4-15(11-17(20)13-28-14-19-3-2-10-27-19)12-23-24-21(25)16-5-7-18(22)8-6-16/h2-12H,13-14H2,1H3,(H,24,25)/b23-12+