3-[4-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-[(2-amino-2-oxo-ethyl)-methyl-sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propanoic acid CAS Name: 3-[4-[(2-amino-2-oxoethyl)-methylsulfamoyl]-3,5-dimethyl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-[(2-amino-2-oxoethyl)-methylsulfamoyl]-3,5-dimethylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-[(2-amino-2-keto-ethyl)-methyl-sulfamoyl]-3,5-dimethyl-pyrazol-1-yl]propionic acid Formula: C11H18N4O5S MolecularWeight: 318.34942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)N(C)CC(=O)N

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)O)C)S(=O)(=O)N(C)CC(=O)N

InChI

InChI=1S/C11H18N4O5S/c1-7-11(21(19,20)14(3)6-9(12)16)8(2)15(13-7)5-4-10(17)18/h4-6H2,1-3H3,(H2,12,16)(H,17,18)