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

Systemtic Name: [5-methyl-2-phenyl-4-(phenylsulfonyl)pyrazol-3-yl] 2-ethoxybenzoate Openeye Name: [4-(benzenesulfonyl)-5-methyl-2-phenyl-pyrazol-3-yl] 2-ethoxybenzoate CAS Name: 2-ethoxybenzoic acid [4-(benzenesulfonyl)-5-methyl-2-phenyl-3-pyrazolyl] ester IUPAC Name: [4-(benzenesulfonyl)-5-methyl-2-phenylpyrazol-3-yl] 2-ethoxybenzoate Traditional Name: 2-ethoxybenzoic acid (4-besyl-5-methyl-2-phenyl-pyrazol-3-yl) ester Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)OC2=C(C(=NN2C3=CC=CC=C3)C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)OC2=C(C(=NN2C3=CC=CC=C3)C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O5S/c1-3-31-22-17-11-10-16-21(22)25(28)32-24-23(33(29,30)20-14-8-5-9-15-20)18(2)26-27(24)19-12-6-4-7-13-19/h4-17H,3H2,1-2H3