N-[[5-fluoranyl-6-(methylsulfamoylmethyl)-2,6-bis(phenylazanyl)pyrimidin-1-yl]methyl]ethanesulfonamide

Systemtic Name: N-[[5-fluoranyl-6-(methylsulfamoylmethyl)-2,6-bis(phenylazanyl)pyrimidin-1-yl]methyl]ethanesulfonamide Openeye Name: N-[[2,6-dianilino-5-fluoro-6-(methylsulfamoylmethyl)pyrimidin-1-yl]methyl]ethanesulfonamide CAS Name: N-[[2,6-dianilino-5-fluoro-6-(methylsulfamoylmethyl)-1-pyrimidinyl]methyl]ethanesulfonamide IUPAC Name: N-[[2,6-dianilino-5-fluoro-6-(methylsulfamoylmethyl)pyrimidin-1-yl]methyl]ethanesulfonamide Traditional Name: N-[[2,6-dianilino-5-fluoro-6-(methylsulfamoylmethyl)pyrimidin-1-yl]methyl]ethanesulfonamide Formula: C21H27FN6O4S2 MolecularWeight: 510.605283

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NCN1C(=NC=C(C1(CS(=O)(=O)NC)NC2=CC=CC=C2)F)NC3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)NCN1C(=NC=C(C1(CS(=O)(=O)NC)NC2=CC=CC=C2)F)NC3=CC=CC=C3

InChI

InChI=1S/C21H27FN6O4S2/c1-3-33(29,30)25-16-28-20(26-17-10-6-4-7-11-17)24-14-19(22)21(28,15-34(31,32)23-2)27-18-12-8-5-9-13-18/h4-14,23,25,27H,3,15-16H2,1-2H3,(H,24,26)