ethyl 5-[(4-chlorophenyl)sulfonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-chlorophenyl)sulfonylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[(4-chlorophenyl)sulfonylamino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[(4-chlorophenyl)sulfonylamino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chlorophenyl)sulfonylamino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[(4-chlorophenyl)sulfonylamino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C21H17ClN4O4S MolecularWeight: 456.90208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN4O4S/c1-2-30-21(27)17-13-23-26(19-12-7-14-5-3-4-6-18(14)24-19)20(17)25-31(28,29)16-10-8-15(22)9-11-16/h3-13,25H,2H2,1H3