1-(6-chloranylpyridazin-3-yl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[2-(pyrazol-1-ylmethyl)benzyl]isonipecotamide Formula: C21H23ClN6O MolecularWeight: 410.89992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2CN3C=CC=N3)C4=NN=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2CN3C=CC=N3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN6O/c22-19-6-7-20(26-25-19)27-12-8-16(9-13-27)21(29)23-14-17-4-1-2-5-18(17)15-28-11-3-10-24-28/h1-7,10-11,16H,8-9,12-15H2,(H,23,29)