2-[[4-(4-chlorophenyl)-2,5-diphenyl-pyrazol-3-yl]methylsulfanyl]benzoyl fluoride

Systemtic Name: 2-[[4-(4-chlorophenyl)-2,5-diphenyl-pyrazol-3-yl]methylsulfanyl]benzoyl fluoride Openeye Name: 2-[[4-(4-chlorophenyl)-2,5-diphenyl-pyrazol-3-yl]methylsulfanyl]benzoyl fluoride CAS Name: 2-[[4-(4-chlorophenyl)-2,5-diphenyl-3-pyrazolyl]methylthio]benzoyl fluoride IUPAC Name: 2-[[4-(4-chlorophenyl)-2,5-diphenylpyrazol-3-yl]methylsulfanyl]benzoyl fluoride Traditional Name: 2-[[4-(4-chlorophenyl)-2,5-diphenyl-pyrazol-3-yl]methylthio]benzoyl fluoride Formula: C29H20ClFN2OS MolecularWeight: 498.998303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2C3=CC=C(C=C3)Cl)CSC4=CC=CC=C4C(=O)F)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2C3=CC=C(C=C3)Cl)CSC4=CC=CC=C4C(=O)F)C5=CC=CC=C5

InChI

InChI=1S/C29H20ClFN2OS/c30-22-17-15-20(16-18-22)27-25(19-35-26-14-8-7-13-24(26)29(31)34)33(23-11-5-2-6-12-23)32-28(27)21-9-3-1-4-10-21/h1-18H,19H2