1-[6-(5-bromanylthiophen-2-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperidine-4-carboxamide

Systemtic Name: 1-[6-(5-bromanylthiophen-2-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperidine-4-carboxamide Openeye Name: 1-[6-(5-bromo-2-thienyl)pyridazin-3-yl]-N-(4-fluorophenyl)piperidine-4-carboxamide CAS Name: 1-[6-(5-bromo-2-thiophenyl)-3-pyridazinyl]-N-(4-fluorophenyl)-4-piperidinecarboxamide IUPAC Name: 1-[6-(5-bromothiophen-2-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperidine-4-carboxamide Traditional Name: 1-[6-(5-bromo-2-thienyl)pyridazin-3-yl]-N-(4-fluorophenyl)isonipecotamide Formula: C20H18BrFN4OS MolecularWeight: 461.350523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)F)C3=NN=C(C=C3)C4=CC=C(S4)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)F)C3=NN=C(C=C3)C4=CC=C(S4)Br

InChI

InChI=1S/C20H18BrFN4OS/c21-18-7-6-17(28-18)16-5-8-19(25-24-16)26-11-9-13(10-12-26)20(27)23-15-3-1-14(22)2-4-15/h1-8,13H,9-12H2,(H,23,27)