N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)quinoline-8-sulfonamide

Systemtic Name: N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)quinoline-8-sulfonamide Openeye Name: N-[1-[2-(2-pyridyl)ethyl]-4-piperidyl]-N-(3-pyridylmethyl)quinoline-8-sulfonamide CAS Name: N-[1-[2-(2-pyridinyl)ethyl]-4-piperidinyl]-N-(3-pyridinylmethyl)-8-quinolinesulfonamide IUPAC Name: N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)quinoline-8-sulfonamide Traditional Name: N-[1-[2-(2-pyridyl)ethyl]-4-piperidyl]-N-(3-pyridylmethyl)quinoline-8-sulfonamide Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)CCC5=CC=CC=N5

Isomeric SMILES

C1CN(CCC1N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4)CCC5=CC=CC=N5

InChI

InChI=1S/C27H29N5O2S/c33-35(34,26-10-3-7-23-8-5-16-30-27(23)26)32(21-22-6-4-14-28-20-22)25-12-18-31(19-13-25)17-11-24-9-1-2-15-29-24/h1-10,14-16,20,25H,11-13,17-19,21H2