ethyl 5-methyl-1-[4-[(4-methylsulfonylphenyl)sulfonylamino]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[(4-methylsulfonylphenyl)sulfonylamino]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[(4-methylsulfonylphenyl)sulfonylamino]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[(4-methylsulfonylphenyl)sulfonylamino]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[(4-methylsulfonylphenyl)sulfonylamino]phenyl]pyrazole-4-carboxylate Traditional Name: 1-[4-[(4-mesylphenyl)sulfonylamino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C20H21N3O6S2 MolecularWeight: 463.52724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C20H21N3O6S2/c1-4-29-20(24)19-13-21-23(14(19)2)16-7-5-15(6-8-16)22-31(27,28)18-11-9-17(10-12-18)30(3,25)26/h5-13,22H,4H2,1-3H3