1-(6-chloranylpyridazin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)piperidine-4-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-(2-phenyl-2-pyrrolidino-ethyl)isonipecotamide Formula: C22H28ClN5O MolecularWeight: 413.94362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2CCN(CC2)C3=NN=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2CCN(CC2)C3=NN=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H28ClN5O/c23-20-8-9-21(26-25-20)28-14-10-18(11-15-28)22(29)24-16-19(27-12-4-5-13-27)17-6-2-1-3-7-17/h1-3,6-9,18-19H,4-5,10-16H2,(H,24,29)