N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]-4-fluoranyl-benzamide Openeye Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenyl-pyrazol-3-yl]-4-fluoro-benzamide CAS Name: N-[5-[(2-chlorophenyl)methylthio]-4-cyano-2-phenyl-3-pyrazolyl]-4-fluorobenzamide IUPAC Name: N-[5-[(2-chlorophenyl)methylsulfanyl]-4-cyano-2-phenylpyrazol-3-yl]-4-fluorobenzamide Traditional Name: N-[5-[(2-chlorobenzyl)thio]-4-cyano-2-phenyl-pyrazol-3-yl]-4-fluoro-benzamide Formula: C24H16ClFN4OS MolecularWeight: 462.926443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)SCC3=CC=CC=C3Cl)C#N)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)SCC3=CC=CC=C3Cl)C#N)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H16ClFN4OS/c25-21-9-5-4-6-17(21)15-32-24-20(14-27)22(30(29-24)19-7-2-1-3-8-19)28-23(31)16-10-12-18(26)13-11-16/h1-13H,15H2,(H,28,31)