ethyl N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(methoxysulfamoyl)phenyl]sulfonyl-carbamimidate

Systemtic Name: ethyl N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(methoxysulfamoyl)phenyl]sulfonyl-carbamimidate Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-2-ethyl-3-[2-(methoxysulfamoyl)phenyl]sulfonyl-isourea CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-N'-[2-(methoxysulfamoyl)phenyl]sulfonylcarbamimidic acid ethyl ester IUPAC Name: ethyl N-(4,6-dimethylpyrimidin-2-yl)-N'-[2-(methoxysulfamoyl)phenyl]sulfonylcarbamimidate Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-2-ethyl-3-[2-(methoxysulfamoyl)phenyl]sulfonyl-isourea Formula: C16H21N5O6S2 MolecularWeight: 443.49784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NOC)NC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCO/C(=N\S(=O)(=O)C1=CC=CC=C1S(=O)(=O)NOC)/NC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C16H21N5O6S2/c1-5-27-16(19-15-17-11(2)10-12(3)18-15)20-28(22,23)13-8-6-7-9-14(13)29(24,25)21-26-4/h6-10,21H,5H2,1-4H3,(H,17,18,19,20)