[5-methyl-2-phenyl-4-(phenylsulfonyl)pyrazol-3-yl] thiophene-2-carboxylate

Systemtic Name: [5-methyl-2-phenyl-4-(phenylsulfonyl)pyrazol-3-yl] thiophene-2-carboxylate Openeye Name: [4-(benzenesulfonyl)-5-methyl-2-phenyl-pyrazol-3-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-(benzenesulfonyl)-5-methyl-2-phenyl-3-pyrazolyl] ester IUPAC Name: [4-(benzenesulfonyl)-5-methyl-2-phenylpyrazol-3-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid (4-besyl-5-methyl-2-phenyl-pyrazol-3-yl) ester Formula: C21H16N2O4S2 MolecularWeight: 424.49274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O4S2/c1-15-19(29(25,26)17-11-6-3-7-12-17)20(27-21(24)18-13-8-14-28-18)23(22-15)16-9-4-2-5-10-16/h2-14H,1H3