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

Systemtic Name: methyl 2-[[2-(4-tert-butylphenyl)quinolin-4-yl]carbonylamino]-4-(4-fluorophenyl)thiophene-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C32H27FN2O3S MolecularWeight: 538.631783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)F)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=CS4)C5=CC=C(C=C5)F)C(=O)OC

InChI

InChI=1S/C32H27FN2O3S/c1-32(2,3)21-13-9-20(10-14-21)27-17-24(23-7-5-6-8-26(23)34-27)29(36)35-30-28(31(37)38-4)25(18-39-30)19-11-15-22(33)16-12-19/h5-18H,1-4H3,(H,35,36)