(3Z)-2-oxidanylidene-3-[2-(phenylsulfonylamino)-1H-pyrimidin-6-ylidene]propanoic acid

Systemtic Name: (3Z)-2-oxidanylidene-3-[2-(phenylsulfonylamino)-1H-pyrimidin-6-ylidene]propanoic acid Openeye Name: (3Z)-3-[2-(benzenesulfonamido)-1H-pyrimidin-6-ylidene]-2-oxo-propanoic acid CAS Name: (3Z)-3-[2-(benzenesulfonamido)-1H-pyrimidin-6-ylidene]-2-oxopropanoic acid IUPAC Name: (3Z)-3-[2-(benzenesulfonamido)-1H-pyrimidin-6-ylidene]-2-oxopropanoic acid Traditional Name: (3Z)-3-[2-(benzenesulfonamido)-1H-pyrimidin-6-ylidene]-2-keto-propionic acid Formula: C13H11N3O5S MolecularWeight: 321.30854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=CC(=O)C(=O)O)N2

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=NC=C/C(=C/C(=O)C(=O)O)/N2

InChI

InChI=1S/C13H11N3O5S/c17-11(12(18)19)8-9-6-7-14-13(15-9)16-22(20,21)10-4-2-1-3-5-10/h1-8H,(H,18,19)(H2,14,15,16)/b9-8-