propan-2-yl 2-methyl-5-(4-methylsulfonylphenyl)-4-pyridin-4-yl-pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 2-methyl-5-(4-methylsulfonylphenyl)-4-pyridin-4-yl-pyrazole-3-carboxylate Openeye Name: isopropyl 2-methyl-5-(4-methylsulfonylphenyl)-4-(4-pyridyl)pyrazole-3-carboxylate CAS Name: 2-methyl-5-(4-methylsulfonylphenyl)-4-pyridin-4-yl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-methyl-5-(4-methylsulfonylphenyl)-4-pyridin-4-ylpyrazole-3-carboxylate Traditional Name: 5-(4-mesylphenyl)-2-methyl-4-(4-pyridyl)pyrazole-3-carboxylic acid isopropyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C(=NN1C)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=NC=C3

Isomeric SMILES

CC(C)OC(=O)C1=C(C(=NN1C)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=NC=C3

InChI

InChI=1S/C20H21N3O4S/c1-13(2)27-20(24)19-17(14-9-11-21-12-10-14)18(22-23(19)3)15-5-7-16(8-6-15)28(4,25)26/h5-13H,1-4H3