1-(6-chloranylpyridazin-3-yl)-N-(3-methylsulfanylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-(3-methylsulfanylphenyl)piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(3-methylsulfanylphenyl)piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[3-(methylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-(3-methylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[3-(methylthio)phenyl]nipecotamide Formula: C17H19ClN4OS MolecularWeight: 362.87696

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C17H19ClN4OS/c1-24-14-6-2-5-13(10-14)19-17(23)12-4-3-9-22(11-12)16-8-7-15(18)20-21-16/h2,5-8,10,12H,3-4,9,11H2,1H3,(H,19,23)