N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-2-(3-pyridyl)cinchoninamide Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3)C4=CC=CS4

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H22N4OS/c1-27(2)21(22-10-6-12-29-22)15-25-23(28)18-13-20(16-7-5-11-24-14-16)26-19-9-4-3-8-17(18)19/h3-14,21H,15H2,1-2H3,(H,25,28)