4-tert-butyl-3-(4-chlorophenyl)-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride

Systemtic Name: 4-tert-butyl-3-(4-chlorophenyl)-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride Openeye Name: 4-tert-butyl-3-(4-chlorophenyl)-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride CAS Name: 4-tert-butyl-3-(4-chlorophenyl)-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride IUPAC Name: 4-tert-butyl-3-(4-chlorophenyl)-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine chloride Traditional Name: [6-amino-4-tert-butyl-3-(4-chlorophenyl)-1,4-dihydro-s-triazin-3-ium-2-yl]amine chloride Formula: C13H19Cl2N5 MolecularWeight: 316.22946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1N=C(NC(=[N+]1C2=CC=C(C=C2)Cl)N)N.[Cl-]

Isomeric SMILES

CC(C)(C)C1N=C(NC(=[N+]1C2=CC=C(C=C2)Cl)N)N.[Cl-]

InChI

InChI=1S/C13H18ClN5.ClH/c1-13(2,3)10-17-11(15)18-12(16)19(10)9-6-4-8(14)5-7-9;/h4-7,10H,1-3H3,(H4,15,16,17,18);1H