ethyl 1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-6,8-bis(fluoranyl)-4-sulfanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-6,8-bis(fluoranyl)-4-sulfanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-7-(2,6-dimethyl-4-pyridyl)-6,8-difluoro-4-thioxo-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-7-(2,6-dimethyl-4-pyridinyl)-6,8-difluoro-4-sulfanylidene-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-6,8-difluoro-4-sulfanylidenequinoline-3-carboxylate Traditional Name: 1-cyclopropyl-7-(2,6-dimethyl-4-pyridyl)-6,8-difluoro-4-thioxo-quinoline-3-carboxylic acid ethyl ester Formula: C22H20F2N2O2S MolecularWeight: 414.468206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=S)F)C3=CC(=NC(=C3)C)C)F)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=S)F)C3=CC(=NC(=C3)C)C)F)C4CC4

InChI

InChI=1S/C22H20F2N2O2S/c1-4-28-22(27)16-10-26(14-5-6-14)20-15(21(16)29)9-17(23)18(19(20)24)13-7-11(2)25-12(3)8-13/h7-10,14H,4-6H2,1-3H3