1-[6-(5-bromanylthiophen-2-yl)pyridazin-3-yl]-N-(3-morpholin-4-ylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[6-(5-bromanylthiophen-2-yl)pyridazin-3-yl]-N-(3-morpholin-4-ylpropyl)piperidine-4-carboxamide Openeye Name: 1-[6-(5-bromo-2-thienyl)pyridazin-3-yl]-N-(3-morpholinopropyl)piperidine-4-carboxamide CAS Name: 1-[6-(5-bromo-2-thiophenyl)-3-pyridazinyl]-N-[3-(4-morpholinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[6-(5-bromothiophen-2-yl)pyridazin-3-yl]-N-(3-morpholin-4-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-[6-(5-bromo-2-thienyl)pyridazin-3-yl]-N-(3-morpholinopropyl)isonipecotamide Formula: C21H28BrN5O2S MolecularWeight: 494.44832

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCN2CCOCC2)C3=NN=C(C=C3)C4=CC=C(S4)Br

Isomeric SMILES

C1CN(CCC1C(=O)NCCCN2CCOCC2)C3=NN=C(C=C3)C4=CC=C(S4)Br

InChI

InChI=1S/C21H28BrN5O2S/c22-19-4-3-18(30-19)17-2-5-20(25-24-17)27-10-6-16(7-11-27)21(28)23-8-1-9-26-12-14-29-15-13-26/h2-5,16H,1,6-15H2,(H,23,28)