ethyl 2-[[2-(4-tert-butylphenyl)quinolin-4-yl]carbonylamino]-4-(4-fluorophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-(4-tert-butylphenyl)quinolin-4-yl]carbonylamino]-4-(4-fluorophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-tert-butylphenyl)quinoline-4-carbonyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate CAS Name: 2-[[[2-(4-tert-butylphenyl)-4-quinolinyl]-oxomethyl]amino]-4-(4-fluorophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-tert-butylphenyl)quinoline-4-carbonyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(4-tert-butylphenyl)quinoline-4-carbonyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C33H29FN2O3S MolecularWeight: 552.658363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C33H29FN2O3S/c1-5-39-32(38)29-26(20-12-16-23(34)17-13-20)19-40-31(29)36-30(37)25-18-28(35-27-9-7-6-8-24(25)27)21-10-14-22(15-11-21)33(2,3)4/h6-19H,5H2,1-4H3,(H,36,37)