Insoluble baker's antifol

Molecular Formula: C₂₃H₃₁FN₆O₆S₂

InChI: InChI=1/C21H25FN6O3S.C2H6O3S/c1-13-12-15(7-10-17(13)32(22,30)31)25-18(29)11-6-14-4-8-16(9-5-14)28-20(24)26-19(23)27-21(28,2)3;1-2-6(3,4)5/h4-5,7-10,12H,6,11H2,1-3H3,(H,25,29)(H4,23,24,26,27);2H2,1H3,(H,3,4,5)/f/h25H,23-24H2;3H

InChIKey: InChIKey=OGONXIUGGALDIV-PFQNOWGVCI
SMILES: CCS(=O)(=O)O.CC1=C(C=CC(=C1)NC(=O)CCC2=CC=C(C=C2)N3C(=NC(=NC3(C)C)N)N)S(=O)(=O)F

Names:
    Baker's Antifol
    Benzenesulfonyl fluoride, 4-((3-(4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl)-1-oxopropyl)amino)-2-methyl-, monoethanesulfonate (9CI)
    Ethanesulfonic acid, compd. with 4-(p-(4,6-diamino-2,2-dimethyl-s-triazin-1(2H)-yl)hydrocinnamamido)-o-toluenesulfonyl fluoride (1:1) (8CI)
    Ethanesulfonic acid, compd. with 4-((3-(4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl)-1-oxopropyl)amino)-2-methylbenzenesulfonyl fluoride (1:1) (9CI)
    Insoluble baker's antifol
    NSC 113423
    1-(4-(N-(3'-Methyl-4'-fluorosulfonyl)phenyl)propanamide)phenyl-4,6- diamino-1,2-dihydro-2,2-dimethyl-s-triazine ethanesulfonate dihydrate
    21321-03-9
    4-[3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]propanoylamino]-2-methyl-benzenesulfonyl fluoride; ethanesulfonic acid

Registries:
    PubChem CID 64840
    PubChem ID 206780