[2-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1,3-benzoxazole-4-carboxylate

Systemtic Name: [2-[[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 1,3-benzoxazole-4-carboxylate Openeye Name: [2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]anilino]-2-oxo-ethyl] 1,3-benzoxazole-4-carboxylate CAS Name: 1,3-benzoxazole-4-carboxylic acid [2-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]anilino]-2-oxoethyl] 1,3-benzoxazole-4-carboxylate Traditional Name: 1,3-benzoxazole-4-carboxylic acid [2-keto-2-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]anilino]ethyl] ester Formula: C21H17N5O6S MolecularWeight: 467.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C4C(=CC=C3)OC=N4

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)COC(=O)C3=C4C(=CC=C3)OC=N4

InChI

InChI=1S/C21H17N5O6S/c1-13-9-10-22-21(24-13)26-33(29,30)15-7-5-14(6-8-15)25-18(27)11-31-20(28)16-3-2-4-17-19(16)23-12-32-17/h2-10,12H,11H2,1H3,(H,25,27)(H,22,24,26)