N-(2-pyridin-2-ylethyl)-2-thiophen-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(2-pyridin-2-ylethyl)-2-thiophen-3-yl-quinoline-4-carboxamide Openeye Name: N-[2-(2-pyridyl)ethyl]-2-(3-thienyl)quinoline-4-carboxamide CAS Name: N-[2-(2-pyridinyl)ethyl]-2-(3-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-(2-pyridin-2-ylethyl)-2-thiophen-3-ylquinoline-4-carboxamide Traditional Name: N-[2-(2-pyridyl)ethyl]-2-(3-thienyl)cinchoninamide Formula: C21H17N3OS MolecularWeight: 359.44418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CSC=C3)C(=O)NCCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CSC=C3)C(=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C21H17N3OS/c25-21(23-11-8-16-5-3-4-10-22-16)18-13-20(15-9-12-26-14-15)24-19-7-2-1-6-17(18)19/h1-7,9-10,12-14H,8,11H2,(H,23,25)