2-[[6,7-bis(chloranyl)quinolin-4-yl]methylsulfanyl]-N-(3-methylphenyl)pyridine-3-carboxamide

Systemtic Name: 2-[[6,7-bis(chloranyl)quinolin-4-yl]methylsulfanyl]-N-(3-methylphenyl)pyridine-3-carboxamide Openeye Name: 2-[(6,7-dichloro-4-quinolyl)methylsulfanyl]-N-(m-tolyl)pyridine-3-carboxamide CAS Name: 2-[(6,7-dichloro-4-quinolinyl)methylthio]-N-(3-methylphenyl)-3-pyridinecarboxamide IUPAC Name: 2-[(6,7-dichloroquinolin-4-yl)methylsulfanyl]-N-(3-methylphenyl)pyridine-3-carboxamide Traditional Name: 2-[(6,7-dichloro-4-quinolyl)methylthio]-N-(m-tolyl)nicotinamide Formula: C23H17Cl2N3OS MolecularWeight: 454.37158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SCC3=C4C=C(C(=CC4=NC=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SCC3=C4C=C(C(=CC4=NC=C3)Cl)Cl

InChI

InChI=1S/C23H17Cl2N3OS/c1-14-4-2-5-16(10-14)28-22(29)17-6-3-8-27-23(17)30-13-15-7-9-26-21-12-20(25)19(24)11-18(15)21/h2-12H,13H2,1H3,(H,28,29)