NSC211623

Molecular Formula: C22H30FN7O6S2


InChI: InChI=1/C20H24FN7O3S.C2H6O3S/c1-12-10-15(32(21,30)31)8-9-16(12)25-19(29)24-11-13-4-6-14(7-5-13)28-18(23)26-17(22)27-20(28,2)3;1-2-6(3,4)5/h4-10H,11H2,1-3H3,(H2,24,25,29)(H4,22,23,26,27);2H2,1H3,(H,3,4,5)/f/h24-25H,22-23H2;3H

InChIKey: InChIKey=LGKDIIPFHZHCBS-ILIKHDDCCB
SMILES: CCS(=O)(=O)O.CC1=C(C=CC(=C1)S(=O)(=O)F)NC(=O)NCC2=CC=C(C=C2)N3C(=NC(=NC3(C)C)N)N

Names:
    NSC211623
    20120-68-7
    4-[[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]-3-methyl-benzenesulfonyl fluoride; ethanesulfonic acid

Registries:
    PubChem CID 309350
    PubChem ID 127102