ethyl 2-[2-(8-fluoranyl-4-oxidanylidene-quinolin-1-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(8-fluoranyl-4-oxidanylidene-quinolin-1-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(8-fluoro-4-oxo-1-quinolyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-(8-fluoro-4-oxo-1-quinolinyl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(8-fluoro-4-oxoquinolin-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(8-fluoro-4-keto-1-quinolyl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C22H21FN2O4S MolecularWeight: 428.476543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C=CC(=O)C4=C3C(=CC=C4)F

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C=CC(=O)C4=C3C(=CC=C4)F

InChI

InChI=1S/C22H21FN2O4S/c1-2-29-22(28)19-14-6-3-4-9-17(14)30-21(19)24-18(27)12-25-11-10-16(26)13-7-5-8-15(23)20(13)25/h5,7-8,10-11H,2-4,6,9,12H2,1H3,(H,24,27)