dimethyl 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzene-1,4-dicarboxylate CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonylamino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H21N3O6S/c1-13-19(14(2)24(22-13)16-8-6-5-7-9-16)31(27,28)23-18-12-15(20(25)29-3)10-11-17(18)21(26)30-4/h5-12,23H,1-4H3