methyl 2-[2-(diethylsulfamoyl)-4-nitro-phenyl]-5-pyridin-4-yl-pyrazole-3-carboxylate

Systemtic Name: methyl 2-[2-(diethylsulfamoyl)-4-nitro-phenyl]-5-pyridin-4-yl-pyrazole-3-carboxylate Openeye Name: methyl 2-[2-(diethylsulfamoyl)-4-nitro-phenyl]-5-(4-pyridyl)pyrazole-3-carboxylate CAS Name: 2-[2-(diethylsulfamoyl)-4-nitrophenyl]-5-pyridin-4-yl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(diethylsulfamoyl)-4-nitrophenyl]-5-pyridin-4-ylpyrazole-3-carboxylate Traditional Name: 2-[2-(diethylsulfamoyl)-4-nitro-phenyl]-5-(4-pyridyl)pyrazole-3-carboxylic acid methyl ester Formula: C20H21N5O6S MolecularWeight: 459.47564

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2C(=CC(=N2)C3=CC=NC=C3)C(=O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N2C(=CC(=N2)C3=CC=NC=C3)C(=O)OC

InChI

InChI=1S/C20H21N5O6S/c1-4-23(5-2)32(29,30)19-12-15(25(27)28)6-7-17(19)24-18(20(26)31-3)13-16(22-24)14-8-10-21-11-9-14/h6-13H,4-5H2,1-3H3