3-[4,6-dimethyl-2-oxidanylidene-1-(2-sulfamoylethyl)pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-[4,6-dimethyl-2-oxidanylidene-1-(2-sulfamoylethyl)pyrimidin-5-yl]propanoic acid Openeye Name: 3-[4,6-dimethyl-2-oxo-1-(2-sulfamoylethyl)pyrimidin-5-yl]propanoic acid CAS Name: 3-[4,6-dimethyl-2-oxo-1-(2-sulfamoylethyl)-5-pyrimidinyl]propanoic acid IUPAC Name: 3-[4,6-dimethyl-2-oxo-1-(2-sulfamoylethyl)pyrimidin-5-yl]propanoic acid Traditional Name: 3-[2-keto-4,6-dimethyl-1-(2-sulfamoylethyl)pyrimidin-5-yl]propionic acid Formula: C11H17N3O5S MolecularWeight: 303.33478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1CCS(=O)(=O)N)C)CCC(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1CCS(=O)(=O)N)C)CCC(=O)O

InChI

InChI=1S/C11H17N3O5S/c1-7-9(3-4-10(15)16)8(2)14(11(17)13-7)5-6-20(12,18)19/h3-6H2,1-2H3,(H,15,16)(H2,12,18,19)