2-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]ethanoic acid Openeye Name: 2-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]acetic acid CAS Name: 2-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(4-methylpiperazin-1-yl)sulfonylpyrazol-1-yl]acetic acid Traditional Name: 2-[4-(4-methylpiperazino)sulfonylpyrazol-1-yl]acetic acid Formula: C10H16N4O4S MolecularWeight: 288.32344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N4O4S/c1-12-2-4-14(5-3-12)19(17,18)9-6-11-13(7-9)8-10(15)16/h6-7H,2-5,8H2,1H3,(H,15,16)