N-[3-[ethyl(phenyl)amino]propyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide

Systemtic Name: N-[3-[ethyl(phenyl)amino]propyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Openeye Name: N-[3-(N-ethylanilino)propyl]-1-[6-(2-thienyl)pyridazin-3-yl]piperidine-4-carboxamide CAS Name: N-[3-(N-ethylanilino)propyl]-1-(6-thiophen-2-yl-3-pyridazinyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(N-ethylanilino)propyl]-1-(6-thiophen-2-ylpyridazin-3-yl)piperidine-4-carboxamide Traditional Name: N-[3-(N-ethylanilino)propyl]-1-[6-(2-thienyl)pyridazin-3-yl]isonipecotamide Formula: C25H31N5OS MolecularWeight: 449.61154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1CCN(CC1)C2=NN=C(C=C2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CCN(CCCNC(=O)C1CCN(CC1)C2=NN=C(C=C2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C25H31N5OS/c1-2-29(21-8-4-3-5-9-21)16-7-15-26-25(31)20-13-17-30(18-14-20)24-12-11-22(27-28-24)23-10-6-19-32-23/h3-6,8-12,19-20H,2,7,13-18H2,1H3,(H,26,31)