[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Openeye Name: [4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone CAS Name: [4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-(3-phenyl-1H-pyrazol-5-yl)methanone IUPAC Name: [4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Traditional Name: [4-(5-chloro-2-fluoro-benzoyl)piperazino]-(3-phenyl-1H-pyrazol-5-yl)methanone Formula: C21H18ClFN4O2 MolecularWeight: 412.844623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NN2)C3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)Cl)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NN2)C3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)Cl)F

InChI

InChI=1S/C21H18ClFN4O2/c22-15-6-7-17(23)16(12-15)20(28)26-8-10-27(11-9-26)21(29)19-13-18(24-25-19)14-4-2-1-3-5-14/h1-7,12-13H,8-11H2,(H,24,25)