3-(4-bromophenyl)-4-ethyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride

Systemtic Name: 3-(4-bromophenyl)-4-ethyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride Openeye Name: 3-(4-bromophenyl)-4-ethyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride CAS Name: 3-(4-bromophenyl)-4-ethyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride IUPAC Name: 3-(4-bromophenyl)-4-ethyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride Traditional Name: [6-amino-3-(4-bromophenyl)-4-ethyl-1,4-dihydro-s-triazin-3-ium-2-yl]amine chloride Formula: C11H15BrClN5 MolecularWeight: 332.6273

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Descriptors Computed from Structure

Canonical SMILES:

CCC1N=C(NC(=[N+]1C2=CC=C(C=C2)Br)N)N.[Cl-]

Isomeric SMILES

CCC1N=C(NC(=[N+]1C2=CC=C(C=C2)Br)N)N.[Cl-]

InChI

InChI=1S/C11H14BrN5.ClH/c1-2-9-15-10(13)16-11(14)17(9)8-5-3-7(12)4-6-8;/h3-6,9H,2H2,1H3,(H4,13,14,15,16);1H