3-[4-(2-dimethylaminoethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-(2-dimethylaminoethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(2-dimethylaminoethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid CAS Name: 3-[4-(2-dimethylaminoethylsulfamoyl)-3,5-dimethyl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(2-dimethylaminoethylsulfamoyl)-3,5-dimethylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(2-dimethylaminoethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]propionic acid Formula: C12H22N4O4S MolecularWeight: 318.39248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)NCCN(C)C

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)NCCN(C)C

InChI

InChI=1S/C12H22N4O4S/c1-9-12(21(19,20)13-6-8-15(3)4)10(2)16(14-9)7-5-11(17)18/h13H,5-8H2,1-4H3,(H,17,18)