6-[[5,7-bis(chloranyl)-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl]sulfanyl]-N-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: 6-[[5,7-bis(chloranyl)-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl]sulfanyl]-N-(phenylmethyl)pyridine-3-carboxamide Openeye Name: N-benzyl-6-[(5,7-dichloro-2-hydroxy-4-oxo-1H-quinolin-3-yl)sulfanyl]pyridine-3-carboxamide CAS Name: 6-[(5,7-dichloro-2-hydroxy-4-oxo-1H-quinolin-3-yl)thio]-N-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: N-benzyl-6-[(5,7-dichloro-2-hydroxy-4-oxo-1H-quinolin-3-yl)sulfanyl]pyridine-3-carboxamide Traditional Name: N-benzyl-6-[(5,7-dichloro-2-hydroxy-4-keto-1H-quinolin-3-yl)thio]nicotinamide Formula: C22H15Cl2N3O3S MolecularWeight: 472.3438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CN=C(C=C2)SC3=C(NC4=CC(=CC(=C4C3=O)Cl)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CN=C(C=C2)SC3=C(NC4=CC(=CC(=C4C3=O)Cl)Cl)O

InChI

InChI=1S/C22H15Cl2N3O3S/c23-14-8-15(24)18-16(9-14)27-22(30)20(19(18)28)31-17-7-6-13(11-25-17)21(29)26-10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H,26,29)(H2,27,28,30)