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

Systemtic Name: N-(pyridin-3-ylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(3-pyridylmethyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(3-pyridinylmethyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(3-pyridylmethyl)-2-(2-thienyl)cinchoninamide Formula: C20H15N3OS MolecularWeight: 345.4176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C20H15N3OS/c24-20(22-13-14-5-3-9-21-12-14)16-11-18(19-8-4-10-25-19)23-17-7-2-1-6-15(16)17/h1-12H,13H2,(H,22,24)