ethyl 1-phenyl-5-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-phenyl-5-[(2-thiophen-2-ylquinolin-4-yl)carbonylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-phenyl-5-[[2-(2-thienyl)quinoline-4-carbonyl]amino]pyrazole-4-carboxylate CAS Name: 5-[[oxo-(2-thiophen-2-yl-4-quinolinyl)methyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-phenyl-5-[(2-thiophen-2-ylquinoline-4-carbonyl)amino]pyrazole-4-carboxylate Traditional Name: 1-phenyl-5-[[2-(2-thienyl)quinoline-4-carbonyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C26H20N4O3S MolecularWeight: 468.527

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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=CS5

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C26H20N4O3S/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)