N-[3-[2-[3-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]phenoxy]ethoxy]phenyl]-2-bromanyl-ethanamide chloride

Systemtic Name: N-[3-[2-[3-[4,6-bis(azanyl)-2,2-dimethyl-1,3,5-triazin-1-yl]phenoxy]ethoxy]phenyl]-2-bromanyl-ethanamide chloride Openeye Name: 2-bromo-N-[3-[2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethoxy]phenyl]acetamide chloride CAS Name: 2-bromo-N-[3-[2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethoxy]phenyl]acetamide chloride IUPAC Name: 2-bromo-N-[3-[2-[3-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethoxy]phenyl]acetamide chloride Traditional Name: 2-bromo-N-[3-[2-[3-(4,6-diamino-2,2-dimethyl-s-triazin-1-yl)phenoxy]ethoxy]phenyl]acetamide chloride Formula: C21H25BrClN6O3- MolecularWeight: 524.8186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(N=C(N1C2=CC(=CC=C2)OCCOC3=CC=CC(=C3)NC(=O)CBr)N)N)C.[Cl-]

Isomeric SMILES

CC1(N=C(N=C(N1C2=CC(=CC=C2)OCCOC3=CC=CC(=C3)NC(=O)CBr)N)N)C.[Cl-]

InChI

InChI=1S/C21H25BrN6O3.ClH/c1-21(2)27-19(23)26-20(24)28(21)15-6-4-8-17(12-15)31-10-9-30-16-7-3-5-14(11-16)25-18(29)13-22;/h3-8,11-12H,9-10,13H2,1-2H3,(H,25,29)(H4,23,24,26,27);1H/p-1