2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]acetamide Formula: C21H19N5O6S2 MolecularWeight: 501.53546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4O3)OC

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4O3)OC

InChI

InChI=1S/C21H19N5O6S2/c1-30-19-11-17(24-20(25-19)31-2)26-34(28,29)14-9-7-13(8-10-14)22-18(27)12-33-21-23-15-5-3-4-6-16(15)32-21/h3-11H,12H2,1-2H3,(H,22,27)(H,24,25,26)