3-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methyl-phenyl]methylsulfamoyl]benzenesulfonyl fluoride

Systemtic Name: 3-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methyl-phenyl]methylsulfamoyl]benzenesulfonyl fluoride Openeye Name: 3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methyl-phenyl]methylsulfamoyl]benzenesulfonyl fluoride CAS Name: 3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]-2-methylphenyl]methylsulfamoyl]benzenesulfonyl fluoride IUPAC Name: 3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methylphenyl]methylsulfamoyl]benzenesulfonyl fluoride Traditional Name: 3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methyl-benzyl]sulfamoyl]benzenesulfonyl fluoride Formula: C25H22Cl2FN5O5S2 MolecularWeight: 626.507083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=C(C(=NC(=N2)N)N)C3=CC(=C(C=C3)Cl)Cl)CNS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)F

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=C(C(=NC(=N2)N)N)C3=CC(=C(C=C3)Cl)Cl)CNS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)F

InChI

InChI=1S/C25H22Cl2FN5O5S2/c1-14-9-17(7-5-16(14)12-31-40(36,37)19-4-2-3-18(11-19)39(28,34)35)38-13-22-23(24(29)33-25(30)32-22)15-6-8-20(26)21(27)10-15/h2-11,31H,12-13H2,1H3,(H4,29,30,32,33)