4-[[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]anilino]-4-oxo-butanoic acid CAS Name: 4-[4-[(2,6-dimethyl-4-pyrimidinyl)sulfamoyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]anilino]-4-oxobutanoic acid Traditional Name: 4-[4-[(2,6-dimethylpyrimidin-4-yl)sulfamoyl]anilino]-4-keto-butyric acid Formula: C16H18N4O5S MolecularWeight: 378.40292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C16H18N4O5S/c1-10-9-14(18-11(2)17-10)20-26(24,25)13-5-3-12(4-6-13)19-15(21)7-8-16(22)23/h3-6,9H,7-8H2,1-2H3,(H,19,21)(H,22,23)(H,17,18,20)