ethyl 5-ethyl-2-[[2-[4-(2-methylpropyl)phenyl]quinolin-4-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[[2-[4-(2-methylpropyl)phenyl]quinolin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-(4-isobutylphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[2-[4-(2-methylpropyl)phenyl]-4-quinolinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-[4-(2-methylpropyl)phenyl]quinoline-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(4-isobutylphenyl)quinoline-4-carbonyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C29H30N2O3S MolecularWeight: 486.6251

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CC(C)C)C(=O)OCC

InChI

InChI=1S/C29H30N2O3S/c1-5-21-16-24(29(33)34-6-2)28(35-21)31-27(32)23-17-26(30-25-10-8-7-9-22(23)25)20-13-11-19(12-14-20)15-18(3)4/h7-14,16-18H,5-6,15H2,1-4H3,(H,31,32)