N-[[5-[(2-ethylpiperidin-1-yl)methyl]furan-2-yl]methyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide

Systemtic Name: N-[[5-[(2-ethylpiperidin-1-yl)methyl]furan-2-yl]methyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Openeye Name: N-[[5-[(2-ethyl-1-piperidyl)methyl]-2-furyl]methyl]-1-[6-(2-thienyl)pyridazin-3-yl]piperidine-4-carboxamide CAS Name: N-[[5-[(2-ethyl-1-piperidinyl)methyl]-2-furanyl]methyl]-1-(6-thiophen-2-yl-3-pyridazinyl)-4-piperidinecarboxamide IUPAC Name: N-[[5-[(2-ethylpiperidin-1-yl)methyl]furan-2-yl]methyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Traditional Name: N-[[5-[(2-ethylpiperidino)methyl]-2-furyl]methyl]-1-[6-(2-thienyl)pyridazin-3-yl]isonipecotamide Formula: C27H35N5O2S MolecularWeight: 493.6641

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC2=CC=C(O2)CNC(=O)C3CCN(CC3)C4=NN=C(C=C4)C5=CC=CS5

Isomeric SMILES

CCC1CCCCN1CC2=CC=C(O2)CNC(=O)C3CCN(CC3)C4=NN=C(C=C4)C5=CC=CS5

InChI

InChI=1S/C27H35N5O2S/c1-2-21-6-3-4-14-32(21)19-23-9-8-22(34-23)18-28-27(33)20-12-15-31(16-13-20)26-11-10-24(29-30-26)25-7-5-17-35-25/h5,7-11,17,20-21H,2-4,6,12-16,18-19H2,1H3,(H,28,33)