ethyl 8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-4-pyridin-4-ylsulfanyl-quinoline-3-carboxylate

Systemtic Name: ethyl 8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-4-pyridin-4-ylsulfanyl-quinoline-3-carboxylate Openeye Name: ethyl 8-[(2,6-dichlorobenzoyl)amino]-4-(4-pyridylsulfanyl)quinoline-3-carboxylate CAS Name: 8-[[(2,6-dichlorophenyl)-oxomethyl]amino]-4-(pyridin-4-ylthio)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 8-[(2,6-dichlorobenzoyl)amino]-4-pyridin-4-ylsulfanylquinoline-3-carboxylate Traditional Name: 8-[(2,6-dichlorobenzoyl)amino]-4-(4-pyridylthio)quinoline-3-carboxylic acid ethyl ester Formula: C24H17Cl2N3O3S MolecularWeight: 498.38108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1SC3=CC=NC=C3)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1SC3=CC=NC=C3)C=CC=C2NC(=O)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C24H17Cl2N3O3S/c1-2-32-24(31)16-13-28-21-15(22(16)33-14-9-11-27-12-10-14)5-3-8-19(21)29-23(30)20-17(25)6-4-7-18(20)26/h3-13H,2H2,1H3,(H,29,30)