N-(3-chloranyl-4-fluoranyl-phenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazine-1-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazine-1-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-[6-(4-fluorophenyl)-3-pyridazinyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazine-1-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazine-1-carboxamide Formula: C21H18ClF2N5O MolecularWeight: 429.850326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC=C(C=C3)F)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC=C(C=C3)F)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H18ClF2N5O/c22-17-13-16(5-6-18(17)24)25-21(30)29-11-9-28(10-12-29)20-8-7-19(26-27-20)14-1-3-15(23)4-2-14/h1-8,13H,9-12H2,(H,25,30)