3-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]propanoic acid CAS Name: 3-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(4-methylpiperazino)sulfonylpyrazol-1-yl]propionic acid Formula: C11H18N4O4S MolecularWeight: 302.35002

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CN(N=C2)CCC(=O)O

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CN(N=C2)CCC(=O)O

InChI

InChI=1S/C11H18N4O4S/c1-13-4-6-15(7-5-13)20(18,19)10-8-12-14(9-10)3-2-11(16)17/h8-9H,2-7H2,1H3,(H,16,17)