2-(4-chlorophenyl)sulfanyl-1-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-1-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(4-chlorophenyl)sulfanyl-1-[3-(4-fluorophenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-[(4-chlorophenyl)thio]-1-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(4-chlorophenyl)sulfanyl-1-[3-(4-fluorophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-[(4-chlorophenyl)thio]-1-[5-(4-fluorophenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C21H16ClFN2OS2 MolecularWeight: 430.945943

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=O)CSC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(N(N=C1C2=CC=CS2)C(=O)CSC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16ClFN2OS2/c22-15-5-9-17(10-6-15)28-13-21(26)25-19(14-3-7-16(23)8-4-14)12-18(24-25)20-2-1-11-27-20/h1-11,19H,12-13H2