N-(3-chloranyl-2-methyl-phenyl)-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-4-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-1-[6-(3-pyridyl)pyridazin-3-yl]piperidine-4-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-1-[6-(3-pyridinyl)-3-pyridazinyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-1-(6-pyridin-3-ylpyridazin-3-yl)piperidine-4-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-1-[6-(3-pyridyl)pyridazin-3-yl]isonipecotamide Formula: C22H22ClN5O MolecularWeight: 407.89598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)C3=NN=C(C=C3)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2CCN(CC2)C3=NN=C(C=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H22ClN5O/c1-15-18(23)5-2-6-19(15)25-22(29)16-9-12-28(13-10-16)21-8-7-20(26-27-21)17-4-3-11-24-14-17/h2-8,11,14,16H,9-10,12-13H2,1H3,(H,25,29)