ethyl 7-carbamothioyl-6-chloranyl-1-ethyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 7-carbamothioyl-6-chloranyl-1-ethyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 7-carbamothioyl-6-chloro-1-ethyl-4-oxo-quinoline-3-carboxylate CAS Name: 7-carbamothioyl-6-chloro-1-ethyl-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-carbamothioyl-6-chloro-1-ethyl-4-oxoquinoline-3-carboxylate Traditional Name: 6-chloro-1-ethyl-4-keto-7-thiocarbamoyl-quinoline-3-carboxylic acid ethyl ester Formula: C15H15ClN2O3S MolecularWeight: 338.8092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(=S)N)Cl)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(=S)N)Cl)C(=O)OCC

InChI

InChI=1S/C15H15ClN2O3S/c1-3-18-7-10(15(20)21-4-2)13(19)9-5-11(16)8(14(17)22)6-12(9)18/h5-7H,3-4H2,1-2H3,(H2,17,22)