1-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]pyrazole-3-carboxylate

Systemtic Name: 1-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]pyrazole-3-carboxylate Openeye Name: 1-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]pyrazole-3-carboxylate CAS Name: 1-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-3-pyrazolecarboxylate IUPAC Name: 1-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]pyrazole-3-carboxylate Traditional Name: 1-[2-keto-2-(4-mesylpiperazino)ethyl]pyrazole-3-carboxylate Formula: C11H15N4O5S- MolecularWeight: 315.3256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CN2C=CC(=N2)C(=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CN2C=CC(=N2)C(=O)[O-]

InChI

InChI=1S/C11H16N4O5S/c1-21(19,20)15-6-4-13(5-7-15)10(16)8-14-3-2-9(12-14)11(17)18/h2-3H,4-8H2,1H3,(H,17,18)/p-1