6-fluoranyl-3-[(1-phenylpyrazol-4-yl)methylidene]thiochromen-4-one

Systemtic Name: 6-fluoranyl-3-[(1-phenylpyrazol-4-yl)methylidene]thiochromen-4-one Openeye Name: 6-fluoro-3-[(1-phenylpyrazol-4-yl)methylene]thiochroman-4-one CAS Name: 6-fluoro-3-[(1-phenyl-4-pyrazolyl)methylidene]-1-benzothiopyran-4-one IUPAC Name: 6-fluoro-3-[(1-phenylpyrazol-4-yl)methylidene]thiochromen-4-one Traditional Name: 6-fluoro-3-[(1-phenylpyrazol-4-yl)methylene]thiochroman-4-one Formula: C19H13FN2OS MolecularWeight: 336.382723

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CN(N=C2)C3=CC=CC=C3)C(=O)C4=C(S1)C=CC(=C4)F

Isomeric SMILES

C1C(=CC2=CN(N=C2)C3=CC=CC=C3)C(=O)C4=C(S1)C=CC(=C4)F

InChI

InChI=1S/C19H13FN2OS/c20-15-6-7-18-17(9-15)19(23)14(12-24-18)8-13-10-21-22(11-13)16-4-2-1-3-5-16/h1-11H,12H2