ethyl 5-(2,2-dimethylpropanoylamino)-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(2,2-dimethylpropanoylamino)-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(2,2-dimethylpropanoylamino)-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[(2,2-dimethyl-1-oxopropyl)amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2,2-dimethylpropanoylamino)-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-(pivaloylamino)-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C(C)(C)C

InChI

InChI=1S/C20H22N4O3/c1-5-27-18(25)14-12-21-24(17(14)23-19(26)20(2,3)4)16-11-10-13-8-6-7-9-15(13)22-16/h6-12H,5H2,1-4H3,(H,23,26)