N-[3-(1,2-oxazol-5-yl)phenyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide

Systemtic Name: N-[3-(1,2-oxazol-5-yl)phenyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Openeye Name: N-(3-isoxazol-5-ylphenyl)-1-[6-(2-thienyl)pyridazin-3-yl]piperidine-4-carboxamide CAS Name: N-[3-(5-isoxazolyl)phenyl]-1-(6-thiophen-2-yl-3-pyridazinyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(1,2-oxazol-5-yl)phenyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Traditional Name: N-(3-isoxazol-5-ylphenyl)-1-[6-(2-thienyl)pyridazin-3-yl]isonipecotamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C3=CC=NO3)C4=NN=C(C=C4)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C3=CC=NO3)C4=NN=C(C=C4)C5=CC=CS5

InChI

InChI=1S/C23H21N5O2S/c29-23(25-18-4-1-3-17(15-18)20-8-11-24-30-20)16-9-12-28(13-10-16)22-7-6-19(26-27-22)21-5-2-14-31-21/h1-8,11,14-16H,9-10,12-13H2,(H,25,29)