1-[3-(3,4-dichlorophenyl)-1-(3-fluorophenyl)pyrazol-4-yl]-2-pyrrolidin-1-yl-ethanone

Systemtic Name: 1-[3-(3,4-dichlorophenyl)-1-(3-fluorophenyl)pyrazol-4-yl]-2-pyrrolidin-1-yl-ethanone Openeye Name: 1-[3-(3,4-dichlorophenyl)-1-(3-fluorophenyl)pyrazol-4-yl]-2-pyrrolidin-1-yl-ethanone CAS Name: 1-[3-(3,4-dichlorophenyl)-1-(3-fluorophenyl)-4-pyrazolyl]-2-(1-pyrrolidinyl)ethanone IUPAC Name: 1-[3-(3,4-dichlorophenyl)-1-(3-fluorophenyl)pyrazol-4-yl]-2-pyrrolidin-1-ylethanone Traditional Name: 1-[3-(3,4-dichlorophenyl)-1-(3-fluorophenyl)pyrazol-4-yl]-2-pyrrolidino-ethanone Formula: C21H18Cl2FN3O MolecularWeight: 418.291523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)C2=CN(N=C2C3=CC(=C(C=C3)Cl)Cl)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCN(C1)CC(=O)C2=CN(N=C2C3=CC(=C(C=C3)Cl)Cl)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H18Cl2FN3O/c22-18-7-6-14(10-19(18)23)21-17(20(28)13-26-8-1-2-9-26)12-27(25-21)16-5-3-4-15(24)11-16/h3-7,10-12H,1-2,8-9,13H2