2-(pyridin-4-ylmethylsulfanyl)-N-quinolin-2-yl-pyridine-3-carboxamide

Systemtic Name: 2-(pyridin-4-ylmethylsulfanyl)-N-quinolin-2-yl-pyridine-3-carboxamide Openeye Name: 2-(4-pyridylmethylsulfanyl)-N-(2-quinolyl)pyridine-3-carboxamide CAS Name: 2-(pyridin-4-ylmethylthio)-N-(2-quinolinyl)-3-pyridinecarboxamide IUPAC Name: 2-(pyridin-4-ylmethylsulfanyl)-N-quinolin-2-ylpyridine-3-carboxamide Traditional Name: 2-(4-pyridylmethylthio)-N-(2-quinolyl)nicotinamide Formula: C21H16N4OS MolecularWeight: 372.44294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

InChI

InChI=1S/C21H16N4OS/c26-20(25-19-8-7-16-4-1-2-6-18(16)24-19)17-5-3-11-23-21(17)27-14-15-9-12-22-13-10-15/h1-13H,14H2,(H,24,25,26)