N-[(E)-[3-[(4-bromanylpyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-2-fluoranyl-benzamide

Systemtic Name: N-[(E)-[3-[(4-bromanylpyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-2-fluoranyl-benzamide Openeye Name: N-[(E)-[3-[(4-bromopyrazol-1-yl)methyl]-4-methoxy-phenyl]methyleneamino]-2-fluoro-benzamide CAS Name: N-[(E)-[3-[(4-bromo-1-pyrazolyl)methyl]-4-methoxyphenyl]methylideneamino]-2-fluorobenzamide IUPAC Name: N-[(E)-[3-[(4-bromopyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-fluorobenzamide Traditional Name: N-[(E)-[3-[(4-bromopyrazol-1-yl)methyl]-4-methoxy-benzylidene]amino]-2-fluoro-benzamide Formula: C19H16BrFN4O2 MolecularWeight: 431.258343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=CC=C2F)CN3C=C(C=N3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC=CC=C2F)CN3C=C(C=N3)Br

InChI

InChI=1S/C19H16BrFN4O2/c1-27-18-7-6-13(8-14(18)11-25-12-15(20)10-23-25)9-22-24-19(26)16-4-2-3-5-17(16)21/h2-10,12H,11H2,1H3,(H,24,26)/b22-9+