ethyl 1-(2-azanyl-2-sulfanylidene-ethyl)-7-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-(2-azanyl-2-sulfanylidene-ethyl)-7-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-(2-amino-2-thioxo-ethyl)-7-chloro-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 1-(2-amino-2-sulfanylideneethyl)-7-chloro-6-fluoro-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-amino-2-sulfanylideneethyl)-7-chloro-6-fluoro-4-oxoquinoline-3-carboxylate Traditional Name: 1-(2-amino-2-thioxo-ethyl)-7-chloro-6-fluoro-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C14H12ClFN2O3S MolecularWeight: 342.773083

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)Cl)CC(=S)N

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)Cl)CC(=S)N

InChI

InChI=1S/C14H12ClFN2O3S/c1-2-21-14(20)8-5-18(6-12(17)22)11-4-9(15)10(16)3-7(11)13(8)19/h3-5H,2,6H2,1H3,(H2,17,22)