ethyl 5-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[2-(furan-2-yl)quinolin-4-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[2-(2-furyl)quinoline-4-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[[2-(2-furanyl)-4-quinolinyl]-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[[2-(2-furyl)quinoline-4-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C26H20N4O4 MolecularWeight: 452.4614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

InChI

InChI=1S/C26H20N4O4/c1-2-33-26(32)20-16-27-30(17-9-4-3-5-10-17)24(20)29-25(31)19-15-22(23-13-8-14-34-23)28-21-12-7-6-11-18(19)21/h3-16H,2H2,1H3,(H,29,31)