ethyl 5-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[(1,3-dioxo-2-phenethyl-isoindoline-5-carbonyl)amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[(1,3-dioxo-2-phenethyl-5-isoindolyl)-oxomethyl]amino]-1-(4-methyl-2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(1,3-dioxo-2-phenethylisoindole-5-carbonyl)amino]-1-(4-methylquinolin-2-yl)pyrazole-4-carboxylate Traditional Name: 5-[(1,3-diketo-2-phenethyl-isoindoline-5-carbonyl)amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C33H27N5O5 MolecularWeight: 573.59798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CCC6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CCC6=CC=CC=C6

InChI

InChI=1S/C33H27N5O5/c1-3-43-33(42)26-19-34-38(28-17-20(2)23-11-7-8-12-27(23)35-28)29(26)36-30(39)22-13-14-24-25(18-22)32(41)37(31(24)40)16-15-21-9-5-4-6-10-21/h4-14,17-19H,3,15-16H2,1-2H3,(H,36,39)