1-(6-chloranylpyridazin-3-yl)-N-[3-(diethylcarbamoyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[3-(diethylcarbamoyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-[3-(diethylcarbamoyl)phenyl]piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[3-[diethylamino(oxo)methyl]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[3-(diethylcarbamoyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[3-(diethylcarbamoyl)phenyl]nipecotamide Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN5O2/c1-3-26(4-2)21(29)15-7-5-9-17(13-15)23-20(28)16-8-6-12-27(14-16)19-11-10-18(22)24-25-19/h5,7,9-11,13,16H,3-4,6,8,12,14H2,1-2H3,(H,23,28)