3-(4-ethylsulfonylpiperazin-1-yl)carbonyl-1-methyl-pyrazole-4-carboxylate

Systemtic Name: 3-(4-ethylsulfonylpiperazin-1-yl)carbonyl-1-methyl-pyrazole-4-carboxylate Openeye Name: 3-(4-ethylsulfonylpiperazine-1-carbonyl)-1-methyl-pyrazole-4-carboxylate CAS Name: 3-[(4-ethylsulfonyl-1-piperazinyl)-oxomethyl]-1-methyl-4-pyrazolecarboxylate IUPAC Name: 3-(4-ethylsulfonylpiperazine-1-carbonyl)-1-methylpyrazole-4-carboxylate Traditional Name: 3-(4-esylpiperazine-1-carbonyl)-1-methyl-pyrazole-4-carboxylate Formula: C12H17N4O5S- MolecularWeight: 329.35218

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C(=O)C2=NN(C=C2C(=O)[O-])C

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C(=O)C2=NN(C=C2C(=O)[O-])C

InChI

InChI=1S/C12H18N4O5S/c1-3-22(20,21)16-6-4-15(5-7-16)11(17)10-9(12(18)19)8-14(2)13-10/h8H,3-7H2,1-2H3,(H,18,19)/p-1