N-(2-methylquinolin-6-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(2-methylquinolin-6-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(2-methyl-6-quinolyl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(2-methyl-6-quinolinyl)-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-methylquinolin-6-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(2-methyl-6-quinolyl)-2-(4-pyridylmethylthio)nicotinamide Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=CC=NC=C4

InChI

InChI=1S/C22H18N4OS/c1-15-4-5-17-13-18(6-7-20(17)25-15)26-21(27)19-3-2-10-24-22(19)28-14-16-8-11-23-12-9-16/h2-13H,14H2,1H3,(H,26,27)