4-[2-[4-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]-2-bromanyl-phenoxy]ethanoylamino]benzenesulfonyl fluoride

Systemtic Name: 4-[2-[4-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]-2-bromanyl-phenoxy]ethanoylamino]benzenesulfonyl fluoride Openeye Name: 4-[[2-[2-bromo-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]acetyl]amino]benzenesulfonyl fluoride CAS Name: 4-[[2-[2-bromo-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]-1-oxoethyl]amino]benzenesulfonyl fluoride IUPAC Name: 4-[[2-[2-bromo-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]acetyl]amino]benzenesulfonyl fluoride Traditional Name: 4-[[2-[2-bromo-4-(4,6-diamino-2,2-dimethyl-s-triazin-1-yl)phenoxy]acetyl]amino]benzenesulfonyl fluoride Formula: C19H20BrFN6O4S MolecularWeight: 527.367303

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(N=C(N1C2=CC(=C(C=C2)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)F)Br)N)N)C

Isomeric SMILES

CC1(N=C(N=C(N1C2=CC(=C(C=C2)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)F)Br)N)N)C

InChI

InChI=1S/C19H20BrFN6O4S/c1-19(2)26-17(22)25-18(23)27(19)12-5-8-15(14(20)9-12)31-10-16(28)24-11-3-6-13(7-4-11)32(21,29)30/h3-9H,10H2,1-2H3,(H,24,28)(H4,22,23,25,26)