N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[[3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C22H17FN4OS MolecularWeight: 404.459983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)C4=CC=CNC4=S

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)CNC(=O)C4=CC=CNC4=S

InChI

InChI=1S/C22H17FN4OS/c23-17-10-8-15(9-11-17)20-16(14-27(26-20)18-5-2-1-3-6-18)13-25-21(28)19-7-4-12-24-22(19)29/h1-12,14H,13H2,(H,24,29)(H,25,28)