ethyl 2-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-(4-ethylphenyl)quinolin-4-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[2-(4-ethylphenyl)-4-quinolinyl]-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-ethylphenyl)quinoline-4-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H26N2O3S MolecularWeight: 458.57194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C)C(=O)OCC

InChI

InChI=1S/C27H26N2O3S/c1-5-18-11-13-19(14-12-18)23-15-21(20-9-7-8-10-22(20)28-23)25(30)29-26-24(27(31)32-6-2)16(3)17(4)33-26/h7-15H,5-6H2,1-4H3,(H,29,30)