2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]isoindoline-5-carboxylate Formula: C20H13N4O6S- MolecularWeight: 437.40542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)[O-]

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C20H14N4O6S/c1-11-8-9-21-20(22-11)23-31(29,30)14-5-3-13(4-6-14)24-17(25)15-7-2-12(19(27)28)10-16(15)18(24)26/h2-10H,1H3,(H,27,28)(H,21,22,23)/p-1