N-[4-(piperidin-1-ylmethyl)phenyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide

Systemtic Name: N-[4-(piperidin-1-ylmethyl)phenyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Openeye Name: N-[4-(1-piperidylmethyl)phenyl]-1-[6-(2-thienyl)pyridazin-3-yl]piperidine-4-carboxamide CAS Name: N-[4-(1-piperidinylmethyl)phenyl]-1-(6-thiophen-2-yl-3-pyridazinyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(piperidin-1-ylmethyl)phenyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Traditional Name: N-[4-(piperidinomethyl)phenyl]-1-[6-(2-thienyl)pyridazin-3-yl]isonipecotamide Formula: C26H31N5OS MolecularWeight: 461.62224

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3CCN(CC3)C4=NN=C(C=C4)C5=CC=CS5

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3CCN(CC3)C4=NN=C(C=C4)C5=CC=CS5

InChI

InChI=1S/C26H31N5OS/c32-26(27-22-8-6-20(7-9-22)19-30-14-2-1-3-15-30)21-12-16-31(17-13-21)25-11-10-23(28-29-25)24-5-4-18-33-24/h4-11,18,21H,1-3,12-17,19H2,(H,27,32)