methyl 4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyrazole-3-carboxylate

Systemtic Name: methyl 4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)pyrazole-3-carboxylate Openeye Name: methyl 2-benzyl-5-(4-methylsulfonylphenyl)-4-(p-tolyl)pyrazole-3-carboxylate CAS Name: 4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-2-(phenylmethyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-4-(4-methylphenyl)-5-(4-methylsulfonylphenyl)pyrazole-3-carboxylate Traditional Name: 2-benzyl-5-(4-mesylphenyl)-4-(p-tolyl)pyrazole-3-carboxylic acid methyl ester Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C26H24N2O4S/c1-18-9-11-20(12-10-18)23-24(21-13-15-22(16-14-21)33(3,30)31)27-28(25(23)26(29)32-2)17-19-7-5-4-6-8-19/h4-16H,17H2,1-3H3