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

Systemtic Name: ethyl 5-(cyclohexylcarbonylamino)-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-(cyclohexanecarbonylamino)-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[cyclohexyl(oxo)methyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(cyclohexanecarbonylamino)-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-(cyclohexanecarbonylamino)-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C22H24N4O3 MolecularWeight: 392.45096

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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)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)C4CCCCC4

InChI

InChI=1S/C22H24N4O3/c1-2-29-22(28)17-14-23-26(19-13-12-15-8-6-7-11-18(15)24-19)20(17)25-21(27)16-9-4-3-5-10-16/h6-8,11-14,16H,2-5,9-10H2,1H3,(H,25,27)