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

Systemtic Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl] pyridine-2-carboxylate Openeye Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl] pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid [2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl] pyridine-2-carboxylate Traditional Name: picolinic acid [2-keto-2-(4-mesylpiperazino)ethyl] ester Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)C2=CC=CC=N2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)COC(=O)C2=CC=CC=N2

InChI

InChI=1S/C13H17N3O5S/c1-22(19,20)16-8-6-15(7-9-16)12(17)10-21-13(18)11-4-2-3-5-14-11/h2-5H,6-10H2,1H3