sodium (Z)-4-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: sodium (Z)-4-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: sodium (Z)-4-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]anilino]-4-oxo-but-2-enoate CAS Name: sodium (Z)-4-[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]anilino]-4-oxo-2-butenoate IUPAC Name: sodium (Z)-4-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]anilino]-4-oxobut-2-enoate Traditional Name: sodium (Z)-4-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]anilino]-4-keto-but-2-enoate Formula: C16H15N4NaO7S MolecularWeight: 430.36767

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC(=O)[O-])OC.[Na+]

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)/C=C\C(=O)[O-])OC.[Na+]

InChI

InChI=1S/C16H16N4O7S.Na/c1-26-14-9-12(18-16(19-14)27-2)20-28(24,25)11-5-3-10(4-6-11)17-13(21)7-8-15(22)23;/h3-9H,1-2H3,(H,17,21)(H,22,23)(H,18,19,20);/q;+1/p-1/b8-7-;