ethyl 8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-4-sulfanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-4-sulfanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 8-[(2,6-dichlorobenzoyl)amino]-4-thioxo-1H-quinoline-3-carboxylate CAS Name: 8-[[(2,6-dichlorophenyl)-oxomethyl]amino]-4-sulfanylidene-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-[(2,6-dichlorobenzoyl)amino]-4-sulfanylidene-1H-quinoline-3-carboxylate Traditional Name: 8-[(2,6-dichlorobenzoyl)amino]-4-thioxo-1H-quinoline-3-carboxylic acid ethyl ester Formula: C19H14Cl2N2O3S MolecularWeight: 421.29706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=S)C=CC=C2NC(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=S)C=CC=C2NC(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C19H14Cl2N2O3S/c1-2-26-19(25)11-9-22-16-10(17(11)27)5-3-8-14(16)23-18(24)15-12(20)6-4-7-13(15)21/h3-9H,2H2,1H3,(H,22,27)(H,23,24)