3-[4-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfamoyl]pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfamoyl]pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[[2-(isopropylamino)-2-oxo-ethyl]sulfamoyl]pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[[2-oxo-2-(propan-2-ylamino)ethyl]sulfamoyl]-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[[2-oxo-2-(propan-2-ylamino)ethyl]sulfamoyl]pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[[2-(isopropylamino)-2-keto-ethyl]sulfamoyl]pyrazol-1-yl]propionic acid Formula: C11H18N4O5S MolecularWeight: 318.34942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNS(=O)(=O)C1=CN(N=C1)CCC(=O)O

Isomeric SMILES

CC(C)NC(=O)CNS(=O)(=O)C1=CN(N=C1)CCC(=O)O

InChI

InChI=1S/C11H18N4O5S/c1-8(2)14-10(16)6-13-21(19,20)9-5-12-15(7-9)4-3-11(17)18/h5,7-8,13H,3-4,6H2,1-2H3,(H,14,16)(H,17,18)