3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropanoic acid

Systemtic Name: 3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropanoic acid Openeye Name: 3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropanoic acid CAS Name: 3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]propanoic acid IUPAC Name: 3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropanoic acid Traditional Name: 3-[4-(2-pyrimidyl)piperazino]sulfonylpropionic acid Formula: C11H16N4O4S MolecularWeight: 300.33414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCC(=O)O

InChI

InChI=1S/C11H16N4O4S/c16-10(17)2-9-20(18,19)15-7-5-14(6-8-15)11-12-3-1-4-13-11/h1,3-4H,2,5-9H2,(H,16,17)